NJTUORMLOPXPBY-UHFFFAOYSA-N CC(C)N(CCC(=O)c1cc2ccccc2cc1)Cc1ccccc1.Cl 176406 1 NB2011_RBC 107.0993778 0 0 1 100% 0 ODZGYELAMAOARP-UHFFFAOYSA-N c1c2c(ccc1)c(=O)c1c3c2nn(c3ccc1)C 11665831 1 NB2011_RBC 107.4950081 0 0 1 100% 0 ZUDPNBZMAJGYTE-UHFFFAOYSA-N CS(=O)(=O)O.c1cc(cnc1)c1cc2c(cc1)NC(=O)C2=Cc1ccc[nH]1 24906278 1 NB2011_RBC 102.3766199 0 0 1 100% 0 AVLYNJZZQYEFEA-UHFFFAOYSA-N c1ccc2c(c1)[nH]c(=C(C#N)c1nc(ncc1)NCCc1cnccc1)s2 71433861 1 NB2011_RBC 101.4758169 0 0 1 100% 0 KQMPRSZTUSSXND-UHFFFAOYSA-N CCOc1c(c(cc(n1)NC(=O)Cc1c(ccc(c1)OC)OC)N)C#N 11624601 1 NB2011_RBC 104.312299 0 0 1 100% 0 ZXVUBPLDUMSDOE-UHFFFAOYSA-N C1CCc2c(C1)c(c(s2)NC(=O)c1cccc2ccccc12)C#N.O 16760525 1 NB2011_RBC 110.654277 0 0 1 100% 0 KOZFSFOOLUUIGY-IYYJOCMQSA-N C[C@]12[C@@](C[C@H](O1)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c13)CNC4=O)(C(=O)OC)O 490561 1 NB2011_RBC 10.76855935 1 1 0 100% 1 QQUXFYAWXPMDOE-UHFFFAOYSA-N C1c2c(c3ccccc3NC1=O)[nH]c1c2cc(cc1)Br 3820 1 NB2011_RBC 105.2100766 0 0 1 100% 0 BLLBARDQJSOSJD-PGUFJCEWSA-N CN([C@H](Cc1ccc(cc1)OOSOc1cccc2c1ccnc2)C(=O)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1cccc2c1ccnc2 - 1 NB2011_RBC 106.9600197 0 0 1 100% 0 LLLQTDSSHZREGW-UHFFFAOYSA-N CN(CC=Cc1ccc(cc1)Cl)Cc1ccccc1N(CCO)S(=O)(=O)c1ccc(cc1)OC 3837 1 NB2011_RBC 103.904521 0 0 1 100% 0 FMETVQKSDIOGPX-UHFFFAOYSA-N C1CCC(C1)n1cc(c2c1ncnc2N)c1ccc(cc1)Oc1ccccc1 6603792 1 NB2011_RBC 105.5757185 0 0 1 100% 0 NGAGMBNBKCDCDJ-UHFFFAOYSA-N C1CN(CCN1)c1cc(=O)c2c(o1)c(ccc2)c1ccccc1 3971 1 NB2011_RBC 83.17714506 0 0 1 100% 0 NHBMKTBZZSJUGA-HKRCYGBASA-N c1(c(cccc1)S/C(=C(/c1cccc(c1)[C@H](c1ccncc1)O)\C#N)/N)N - 1 NB2011_RBC 95.88418094 0 0 1 100% 0 GYQSWJNGTWVFOL-UHFFFAOYSA-N C1CC(=O)N(C1=O)C1=C(C(=O)c2ccccc2C1=O)Cl 389898 1 NB2011_RBC 95.10766004 0 0 1 100% 0 JLOXTZFYJNCPIS-UHFFFAOYSA-N c1ccc(c(c1)C(=C(N)Sc1ccc(cc1)N)C#N)C(F)(F)F 24906275 1 NB2011_RBC 101.2567361 0 0 1 100% 0 FPYJSJDOHRDAMT-UHFFFAOYSA-N Cc1c([nH]c(c1C(=O)N1CCN(CC1)C)C)C=C1c2c(ccc(c2)S(=O)(=O)N(C)c2cc(ccc2)Cl)NC1=O 53396327 1 NB2011_RBC 111.0761794 0 0 1 100% 0 UQPMANVRZYYQMD-UHFFFAOYSA-N c1cc(ccc1Nc1c2c(ncnc2n[nH]1)N)F 11644425 1 NB2011_RBC 96.23506805 0 0 1 100% 0 ODYAQBDIXCVKAE-UHFFFAOYSA-N c1ccc(c(c1)c1ccc(cc1)CCCC(=O)Nc1ccc(cc1)O)F 11382492 1 NB2011_RBC 93.49129543 0 0 1 100% 0 IBAKVEUZKHOWNG-UHFFFAOYSA-N c1ccc(cc1)Oc1ccc(cc1)CCNc1ncnc2c1cc(cc2)N 509554 1 NB2011_RBC 110.4086654 0 0 1 100% 0 VXPWQNBKEIVYIS-OAHLLOKOSA-N C[C@H](c1ccccc1)Nc1nccc(c1)c1c([nH]c(n1)SC)c1ccc(cc1)F 10862355 1 NB2011_RBC 114.6103764 0 0 1 100% 0 DZFBYHUKZSRPHU-UHFFFAOYSA-N c1cc(ccc1c1c([nH]n(c1=O)c1ccc(cc1)Cl)c1ccncc1)F 4665 1 NB2011_RBC 91.85048474 0 0 1 100% 0 QFWCYNPOPKQOKV-UHFFFAOYSA-N COc1cccc(c1N)c1cc(=O)c2ccccc2o1 4713 1 NB2011_RBC 95.9761688 0 0 1 100% 0 BGIYKDUASORTBB-UHFFFAOYSA-N c1cc(ccc1c1nc(c([nH]1)c1ccncc1)c1ccc(cc1)F)[N+](=O)[O-] 4712 1 NB2011_RBC 92.85122247 0 0 1 100% 0 KFHMLBXBRCITHF-UHFFFAOYSA-N CNc1ncc2c(c1)c(ncn2)Nc1cc(ccc1)Br 4707 1 NB2011_RBC 114.6759833 0 0 1 100% 0 WUPUZEMRHDROEO-UHFFFAOYSA-N CCC(=O)Nc1cc2c(cc1)ncnc2Nc1cc(ccc1)Br 4709 1 NB2011_RBC 95.51557862 0 0 1 100% 0 CZDUJGOCEPWCNA-UHFFFAOYSA-N CCCC(=O)Oc1cc2c(cc1)[nH]c(c2)C(=O)c1cc2ccccc2[nH]1 5330548 1 NB2011_RBC 99.79056441 0 0 1 100% 0 INTPTKHSGKBHHW-UHFFFAOYSA-N COc1c(cc2c(c1)c(ncn2)N1CCN(CC1)C(=O)Nc1ccc(cc1)Oc1ccccc1)OC 10907042 1 NB2011_RBC 103.0647681 0 0 1 100% 0 ZDNURMVOKAERHZ-UHFFFAOYSA-N COc1c(cc2c(c1)Cc1c2[nH]nc1Nc1cc(ccc1)F)OC 9797370 1 NB2011_RBC 101.9952157 0 0 1 100% 0 PEPCXHNLEXQQSE-UHFFFAOYSA-N Cc1ccccc1C(=O)NC(=S)Nc1ccc(cc1)Oc1c2cc(c(cc2ncc1)OC)OC.O.O.O 16760609 1 NB2011_RBC 107.1653829 0 0 1 100% 0 DGCXNBUJPWPMJJ-UHFFFAOYSA-N n12c(nnn1)nc1c(n2)[C@H](c2c1cccc2)O - 1 NB2011_RBC 88.54780249 0 0 1 100% 0 VFBGXTUGODTSPK-UHFFFAOYSA-N c1cc2c(c3c1NC(=O)C3=Cc1cnc[nH]1)scn2 57351456 1 NB2011_RBC 87.57666145 0 0 1 100% 0 ZJFMARHFPUZEKI-UHFFFAOYSA-N c1cc2c(cc1Cl)C(=Cc1cc(c(c(c1)Cl)O)Cl)C(=O)N2 24906292 1 NB2011_RBC 99.23289655 0 0 1 100% 0 TUVCWJQQGGETHL-UHFFFAOYSA-N O1CCN(CC1)c1nc(nc2c1oc1ncccc21)c1cc(O)ccc1 9884685 1 NB2011_RBC 101.3227431 0 0 1 100% 0 SQWZFLMPDUSYGV-UHFFFAOYSA-N c1cc2nccnc2cc1C=C1C(=O)NC(=O)S1 24906273 1 NB2011_RBC 99.55178739 0 0 1 100% 0 SRLVNYDXMUGOFI-UHFFFAOYSA-N c1cc2c(cc1C=C1C(=O)NC(=O)S1)OC(O2)(F)F 53394675 1 NB2011_RBC 101.7632464 0 0 1 100% 0 GDQXJQSQYMMKRA-UHFFFAOYSA-N CC(C)(C)n1c2c(c(n1)Cc1cccc3ccccc13)c(ncn2)N 5154691 1 NB2011_RBC 55.24721631 0 0 1 100% 0 BMGQWWVMWDBQGC-PZFYLCKJSA-N O1[C@]2(n3c4c5n([C@@H]1C[C@H](N(C)C(=O)c1ccccc1)[C@@H]2OC)c1c(c5c2c(c4c4c3cccc4)CNC2=O)cccc1)C 24202429 1 NB2011_RBC 58.08322015 0 0 1 100% 0 RONQPWQYDRPRGG-UHFFFAOYSA-N c1cc(ccc1Nc1c(cc2c(c1)C(=O)NC2=O)Nc1ccc(cc1)F)F 6711154 1 NB2011_RBC 101.2987555 0 0 1 100% 0 KIWODJBCHRADND-UHFFFAOYSA-N c1ccc(cc1)NC1=C(C(=O)NC1=O)c1cn(c2ccccc12)CCCn1ccnc1 6419755 1 NB2011_RBC 116.8158265 0 0 1 100% 0 PMXCMJLOPOFPBT-OAHLLOKOSA-N CC(C)[C@@H](CO)Nc1nc2c(c(n1)Nc1cc(ccc1)Cl)ncn2C(C)C 12084804 1 NB2011_RBC 113.3370177 0 0 1 100% 0 QFJCIRLUMZQUOT-JRLVRMFHSA-N C[C@@H]1CC[C@@H]2C[C@@H](C(=CC=CC=C[C@@H](C[C@@H](C(=O)[C@@H]([C@H](C(=C[C@H](C(=O)C[C@H](OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@]1(O2)O)[C@H](C)C[C@@H]1CC[C@H]([C@@H](C1)OC)O)C)C)O)OC)C)C)C)OC - 1 NB2011_RBC 113.0056715 0 0 1 100% 0 LLJRXVHJOJRCSM-UHFFFAOYSA-N c1ccc2c(c1)c(c[nH]2)c1ccncc1 644354 1 NB2011_RBC 107.0874604 0 0 1 100% 0 CMKMGFAUKPAOMG-AWEZNQCLSA-N NCC(=O)N1CCCN([C@H](C1)C)S(=O)(=O)c1cccc2c1c(cnc2)C 11976582 1 NB2011_RBC 111.9243023 0 0 1 100% 0 FXGHOAZJQNLNFD-KRWDZBQOSA-N c1c2c(ccc1)n1c(c2C2=C(C(=O)NC2=O)c2cn(c3c2cccc3)C)C[C@H](CC1)CN(C)C 127757 1 NB2011_RBC 108.4654575 0 0 1 100% 0 XFXDYDZBKXMGBX-HOTGVXAUSA-N c1cc(ccn1)[C@H]1[C@@H](N=C(N1)c1ccc(cc1)OC)CC - 1 NB2011_RBC 102.5313061 0 0 1 100% 0 NJNKPVPFGLGHPA-UHFFFAOYSA-N C1=CC(=O)C=CC1=c1[nH]c(c([nH]1)c1ccncc1)c1ccc(cc1)F - 1 NB2011_RBC 78.37180069 0 0 1 100% 0 CDMGBJANTYXAIV-MHZLTWQESA-N C[S@](=O)c1ccc(cc1)c1nc(c([nH]1)c1ccncc1)c1ccc(cc1)F 9543416 1 NB2011_RBC 106.667792 0 0 1 100% 0 VSPFURGQAYMVAN-UHFFFAOYSA-N C1CNCCC1n1cnc(c1c1nc(ncc1)N)c1ccc(cc1)F 5164 1 NB2011_RBC 105.4600376 0 0 1 100% 0 OTPNDVKVEAIXTI-IYBDPMFKSA-N C1C[C@@H]2n3c4ccccc4c4c5c(c6c7ccccc7n([C@H]1O2)c6c34)c(=O)[nH]c5=O 447446 1 NB2011_RBC 39.80966662 1 1 0 100% 1 BHWCZLOXTLWZAQ-UHFFFAOYSA-N Cc1nc(c(o1)c1ccncc1)c1ccccc1 5174 1 NB2011_RBC 107.6676424 0 0 1 100% 0 YOELZIQOLWZLQC-UHFFFAOYSA-N C1CSc2nc(c(n12)c1ccncc1)c1ccc(cc1)F 5228 1 NB2011_RBC 115.8081566 0 0 1 100% 0 ZFGXZJKLOFCECI-UHFFFAOYSA-N c1c(ccc(c1)Cl)c1nc(sc1)Nc1ccc(cc1)O 753704 1 NB2011_RBC 111.6417903 0 0 1 100% 0 DMWVGXGXHPOEPT-UHFFFAOYSA-N COc1c(cc2c(c1)c(ncn2)Nc1ccc(cc1)Oc1ccccc1)OC 1474853 1 NB2011_RBC 137.4516043 0 0 1 100% 0 HKSZLNNOFSGOKW-HMWZOHBLSA-N C[C@]12[C@H]([C@H](C[C@H](O1)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c13)CNC4=O)NC)OC 451705 1 NB2011_RBC 3.046331211 1 1 0 100% 1 WNRSTFUVBWNELX-UHFFFAOYSA-N CC(=O)O.c1ccc2c(c1)nc1n2c(=O)c2cccc3c(ccc1c23)C(=O)O 16760660 1 NB2011_RBC 126.5531032 0 0 1 100% 0 LOGJQOUIVKBFGH-UHFFFAOYSA-N CN(C)S(=O)(=O)c1cc2c(cc1)NC(=O)C2=Cc1cc2c([nH]1)CCCC2 5309 1 NB2011_RBC 114.3196759 0 0 1 100% 0 QNUKRWAIZMBVCU-UHFFFAOYSA-N COc1cc2c(cc1)NC(=O)C2=Cc1cnc[nH]1 24906268 1 NB2011_RBC 109.8599463 0 0 1 100% 0 XPLJEFSRINKZLC-UHFFFAOYSA-N CCN(CC)CCNC(=O)c1c([nH]c(c1C)C=C1c2c(ccc(c2)Cl)NC1=O)C 24906267 1 NB2011_RBC 101.4516116 0 0 1 100% 0 MLKHXLFEYOOYEY-UHFFFAOYSA-N Cn1cc(c2ccccc12)C=C1c2c(ccc(c2)S(=O)(=O)N)NC1=O 24906266 1 NB2011_RBC 100.5854026 0 0 1 100% 0 LCACSMNPIITJGG-UHFFFAOYSA-N c1cc(cc(c1)Nc1nc(ncc1C(=O)N)NCCN)C(F)(F)F.O.O.Cl.Cl 16760670 1 NB2011_RBC 97.88598566 0 0 1 100% 0 KFLWBZPSJQPRDD-UHFFFAOYSA-N C1Oc2c(O1)cc(cc2)C=C[N+](=O)[O-] 94945 1 NB2011_RBC 100.9681656 0 0 1 100% 0 NMEUKWOOQOHUNA-UHFFFAOYSA-N c1cc(cnc1)CNc1ncc2c(c1)c(c(cn2)C#N)Nc1cc(c(cc1)F)Cl 9549300 1 NB2011_RBC 115.0086414 0 0 1 100% 0 IBCXZJCWDGCXQT-UHFFFAOYSA-N c1ccc2c(c1)c(ccn2)c1c([nH]nc1)c1ccccn1 447966 1 NB2011_RBC 92.88554675 0 0 1 100% 0 BTUOOXPZOVNPMF-UHFFFAOYSA-N Cc1cccc(n1)c1c(nc([nH]1)C(C)(C)C)c1cc2c(cc1)OCO2.Cl 16079009 1 NB2011_RBC 118.6490128 0 0 1 100% 0 UOHFCPXBKJPCAD-UHFFFAOYSA-N COc1ccc(cc1)C=C(C#N)C#N 2063 1 NB2011_RBC 107.0965199 0 0 1 100% 0 TUCIOBMMDDOEMM-UHFFFAOYSA-N c1ccc(cc1)CNC(=O)C(=Cc1cc(c(cc1)O)O)C#N 2390 1 NB2011_RBC 90.72908224 0 0 1 100% 0 DXVJRTIPBNBLLB-UHFFFAOYSA-N c1cc(ccc1C=C(C#N)C(=C(C#N)C#N)N)O 2045 1 NB2011_RBC 96.80221476 0 0 1 100% 0 FQNCLVJEQCJWSU-UHFFFAOYSA-N Cc1cc2ncc(nc2cc1C)c1ccccc1 2048 1 NB2011_RBC 95.84708961 0 0 1 100% 0 QNOXYUNHIGOWNY-UHFFFAOYSA-N COc1c(cc2c(c1)ncc(n2)c1ccccc1)OC 2049 1 NB2011_RBC 87.55311274 0 0 1 100% 0 GFNNBHLJANVSQV-UHFFFAOYSA-N COc1c(cc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)OC 2051 1 NB2011_RBC 87.91356318 0 0 1 100% 0 PMUJUSJUVIXDQC-UHFFFAOYSA-N CCOC(=O)c1c([nH]c(c1C)C=C1c2ccccc2NC1=O)C 5654 1 NB2011_RBC 88.35852101 0 0 1 100% 0 GGPZCOONYBPZEW-UHFFFAOYSA-N c1ccc(c(c1)C(=O)Nc1ccc(cc1)Cl)NCc1ccncc1 9797919 1 NB2011_RBC 87.40996427 0 0 1 100% 0 YUWFTONEHHSMEI-CZUORRHYSA-N C1=C(C(=C[C@@H]2[C@@H]1C(=NC=N2)Oc1ccc(c(c1)Cl)NC(=O)NCCC)OC)OC - 1 NB2011_RBC 105.8172365 0 0 1 100% 0 RFHPWPWVGFSLOP-UHFFFAOYSA-N C1CCc2c(C1)cc([nH]2)C=C1c2c(ccc(c2)Br)NC1=O 5655 1 NB2011_RBC 98.09359164 0 0 1 100% 0 WUWDLXZGHZSWQZ-UHFFFAOYSA-N Cc1cc(c([nH]1)C=C1c2ccccc2NC1=O)C 123015 1 NB2011_RBC 87.62597372 0 0 1 100% 0 HBWLNACPIFKNIP-UHFFFAOYSA-N COc1ccc(cc1)c1cn2c(c(cn2)c2cscc2)nc1 5329468 1 NB2011_RBC 93.86492509 0 0 1 100% 0 QDLHCMPXEPAAMD-BLNDMVMCSA-N [C@H]1([C@]2(c3c(C(=O)O1)coc3C(=O)C1=C2[C@H](C[C@]2([C@@H]1CCC2=O)C)OC(=O)C)C)COC - 1 NB2011_RBC 96.11134097 0 0 1 100% 0 BLQHLDXMMWHXIT-YSZXOBSOSA-N C[C@@H]([C@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1)N.O.Cl.Cl - 1 NB2011_RBC 88.81966325 0 0 1 100% 0 AXPBLFXFGVEGKU-UHFFFAOYSA-N c1(c(cc(c(c1)Cl)CO)Nc1c(cnc2c1cc(c(c2)OCCCN1CCN(CC1)C)OC)C#N)Cl - 1 NB2011_RBC 99.22167597 0 0 1 100% 0 ZBNZXTGUTAYRHI-UHFFFAOYSA-N c1c(C(=O)Nc2c(cccc2Cl)C)sc(Nc2cc(nc(C)n2)N2CCN(CCO)CC2)n1 3062316 Dasatinib 1 NB2011_RBC 114.3049331 0 0 1 100% 0 PIQCTGMSNWUMAF-UHFFFAOYSA-N C1N(CCN(C1)C)c1cc2c(cc1)nc([nH]2)c1c(c2c([nH]c1=O)cccc2F)N 135398510 1 NB2011_RBC 118.7073609 0 0 1 100% 0 AAKJLRGGTJKAMG-UHFFFAOYSA-N C#Cc1cc(Nc2c3cc(OCCOC)c(OCCOC)cc3ncn2)ccc1 176870 Erlotinib 1 NB2011_RBC 107.5235892 0 0 1 100% 0 XGALLCVXEZPNRQ-UHFFFAOYSA-N C1COCCN1CCCOc1c(cc2c(c1)/c(=N/c1cc(Cl)c(F)cc1)/nc[nH]2)OC 123631 Gefitinib 1 NB2011_RBC 107.1828231 0 0 1 100% 0 KTUFNOKKBVMGRW-UHFFFAOYSA-N c1cc(cnc1)c1ccnc(n1)Nc1c(ccc(c1)NC(=O)c1ccc(cc1)CN1CCN(C)CC1)C 5291 Imatinib 1 NB2011_RBC 106.1842088 0 0 1 100% 0 BCFGMOOMADDAQU-UHFFFAOYSA-N CS(=O)(=O)CCNCc1ccc(o1)c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1 208908 Lapatinib 1 NB2011_RBC 109.5837119 0 0 1 100% 0 WJEOLQLKVOPQFV-UHFFFAOYSA-N Cc1c(cc(cc1)NC(=O)c1ccc(cc1)CN1CCN(CC1)C)Nc1nc(cs1)c1cnccc1 10074640 1 NB2011_RBC 110.1203958 0 0 1 100% 0 ZTFBIUXIQYRUNT-MDWZMJQESA-N c1c(ccc(c1)C(F)(F)F)/C=C/c1occ(n1)COc1ccc(cc1)CCCCn1nncc1 6444692 1 NB2011_RBC 105.0704739 0 0 1 100% 0 HHZIURLSWUIHRB-UHFFFAOYSA-N Cc1c(cc(cc1)C(=O)Nc1cc(cc(c1)n1cc(nc1)C)C(F)(F)F)Nc1nccc(n1)c1cnccc1 644241 Nilotinib 1 NB2011_RBC 112.5481634 0 0 1 100% 0 CUIHSIWYWATEQL-UHFFFAOYSA-N S(=O)(=O)(N)c1c(ccc(Nc2nc(N(c3cc4nn(c(c4cc3)C)C)C)ccn2)c1)C 10113978 Pazopanib 1 NB2011_RBC 111.3581254 0 0 1 100% 0 BTIHMVBBUGXLCJ-OAHLLOKOSA-N OC[C@H](Nc1nc2n(C(C)C)cnc2c(n1)NCc1ccccc1)CC 160355 1 NB2011_RBC 107.8179552 0 0 1 100% 0 MLDQJTXFUGDVEO-UHFFFAOYSA-N c1c(ccc(c1C(F)(F)F)Cl)NC(=O)Nc1ccc(cc1)Oc1ccnc(c1)C(=O)NC 216239 Sorafenib 1 NB2011_RBC 100.0941865 0 0 1 100% 0 WINHZLLDWRZWRT-ATVHPVEESA-N Cc1c(c(C)c(/C=C\2/c3cc(ccc3NC2=O)F)[nH]1)C(=O)NCCN(CC)CC 5329102 Sunitinib 1 NB2011_RBC 109.0879472 0 0 1 100% 0 UXXQOJXBIDBUAC-UHFFFAOYSA-N O(CCCN1CCCCC1)c1cc2ncnc(N3CCN(CC3)C(=O)Nc3ccc(OC(C)C)cc3)c2cc1OC 3038522 1 NB2011_RBC 108.1654952 0 0 1 100% 0 UJLAWZDWDVHWOW-AAEUAGOBSA-N c1(c2c(ncn1)[nH]cc2)N([C@H]1CN(CC[C@@H]1C)C(=O)CC#N)C 25180101 1 NB2011_RBC 110.7326221 0 0 1 100% 0 GCIKSSRWRFVXBI-UHFFFAOYSA-N N1(CCN(CC1)c1cc(nc(n1)Sc1ccc(cc1)NC(=O)C1CC1)Nc1cc(n[nH]1)C)C 5494449 1 NB2011_RBC 111.9971903 0 0 1 100% 0 UHTHHESEBZOYNR-UHFFFAOYSA-N C1CN(C)CCC1COc1cc2c(cc1OC)/c(=N/c1ccc(Br)cc1F)/nc[nH]2 3081361 Vandetanib 1 NB2011_RBC 106.0816612 0 0 1 100% 0 YCOYDOIWSSHVCK-UHFFFAOYSA-N Clc1ccc(Nc2nnc(c3c2cccc3)Cc2ccncc2)cc1 151194 1 NB2011_RBC 115.5106393 0 0 1 100% 0 FYSRKRZDBHOFAY-UHFFFAOYSA-N c1c(c(c(cc1)F)N(c1nc(c(cc1)C(=O)N)c1c(cc(cc1)F)F)C(=O)N)F 10341154 1 NB2011_RBC 109.1801717 0 0 1 100% 0