Compound List

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Compound	Smiles	Mol
C499630	O=C(O)c1noc(-c2ccc(Cl)cc2Cl)c1Cl
C499631	C#Cc1cc(Cl)c(Cl)cc1Cl
C499632	CC1(CO)CC2(CCC2)CO1
C499634	CN(C)S(=O)(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)CC1
C499636	CC12CC(NC(=O)OC(C)(C)C)(CN1)C2
C499637	COC(=O)CC(=O)c1ccc(C)s1
C499640	FC(F)(F)C1CCC2(CCNC2)CC1
C499642	Brc1ccc2oc(-c3ccccc3)nc2c1
C499643	COC(=O)c1ocnc1-c1cn(Cc2ccccc2)nn1
C499644	CC(C)(C)OC(=O)NC1(CCCCN)CCC1
C499645	Oc1nc(O)c2nc(O)nc(O)c2n1
C499648	CC(C)(C)S(=O)(=O)C12CC1C2
C499649	CC(C)(C)OC(=O)N1CC(C(=O)O)CC(P(C)(C)=O)C1
C499652	O=C(O)CCc1cccc(S(=O)(=O)F)c1
C499655	CC1CCN(c2ccccc2)C1=O
C499657	CCC1(C(=O)c2ccccc2)CCC1
C499658	CN(C)C(=O)c1ccc(C2=CCNCC2)cc1
C499659	CCCC(C(=O)OCC)C(F)(F)F
C499660	CC(C)(N)CN1CCS(=O)(=O)CC1
C499661	CC1(C(=O)O)CC1c1cc(Cl)cc(Cl)c1
C499666	CNCc1ccc(O)nc1
C499667	NCCN1C(=O)NC2CSC(CCCCC(=O)O)C21
C499668	Cc1cc(N2CCOCC2)ccc1Br
C499669	Cc1cc(C)nc(-c2ccccc2)n1
C499670	CN(c1nc(C(=O)O)c(O)c(=O)n1C)C(c1ccccc1)c1ccccc1
C499673	Cc1ccc(C2CC(C(F)(F)F)n3nccc3N2)cc1
C499674	Cc1n[nH]c2ncc(NCc3ccccc3)cc12
C499676	CC(C)(C)OC(=O)C1(c2cccc(Br)c2)CC1
C499677	CC(C)(C)OC(=O)N1CCCc2nc(N)ncc2C1
C499678	CC(C)(C)OC(=O)NC1CC2(CCC(C(=O)O)C2)C1
C499679	O=C(O)c1cn(-c2nc(C3CC3)ns2)cn1
C499680	COCC1CC(O)CN1C(=O)OCc1ccccc1
C499681	Clc1cncc(-n2ccnc2)n1
C499684	Cc1nc2cc(C(F)(F)F)ccc2n1C1CCNCC1
C499686	ClCc1cc2n(n1)CCCO2
C499689	CCOC(=O)N1CCCC1c1cccc(Br)c1
C499691	CCOC(=O)CNC(=O)Nc1ccc(N(C)C)cc1
C499692	COC(=O)c1ccc(NN)s1
C499694	Cc1cc2cc[nH]c(=O)c2n1C
C499695	CC(C)(C)OC(=O)N1CCC(C2OC3(C)CC2(C(=O)O)C3)CC1
C499696	Cc1c(Br)cccc1C(F)F
C499700	CC(C)(C)OC(=O)NCCN1C(=O)c2cccc(F)c2C1=O
C499702	CC(C)(C)OC(=O)N1CC2(N)CC(C(F)F)(C1)C2
C499707	CC(C)(N)c1c(F)cccc1Cl
C499709	COC(=O)c1cnc(CCCN)s1
C499710	NCC1(N2CCC(O)CC2)CCOCC1
C499711	CC(C)(C)OC(=O)Nc1cc(N)cc(C(F)(F)F)c1
C499714	CCCC[Sn](CCCC)(CCCC)c1nc2ccccc2n1C
C499715	CC(C)(C)OC(=O)N1CC(CB2OC(C)(C)C(C)(C)O2)(c2ccccc2)C1
C499717	Brc1ccc(C2CCNCC2)s1
C499718	O=C(Cc1c[nH]c2ccccc12)ON1C(=O)c2ccccc2C1=O
C499720	CC1(C(=O)O)CCN(C(=O)OCC2c3ccccc3-c3ccccc32)CC1(F)F
C499721	COC(=O)c1sc2cccc(C)c2c1N
C499723	Sc1cc2c(cc1Br)OCO2
C499724	O=C(O)C(CF)(CF)CBr
C499726	COC(=O)c1cc(B2OC(C)(C)C(C)(C)O2)c(Cl)s1
C499727	CN(C)CC=CB1OC(C)(C)C(C)(C)O1
C499729	CNC1CCCC1SC
C499731	Cc1nc(CCCc2ccccc2)oc1N1CCCC1C#N
C499738	CNC1CC(COC)C1
C499745	COc1nc(C(F)(F)F)c(C#N)cc1C#N
C499746	COc1ccccc1N1CCN(CCCNC(=O)N2c3ccccc3Sc3ccccc32)CC1
C499747	CC1(C)CC(O)CN1S(=O)(=O)c1ccccc1[N+](=O)[O-]
C499751	NS(=O)(=O)CC12CC1CCC2(F)F
C499753	Cn1c(=O)c2c(ncn2CCS(=O)(=O)F)n(C)c1=O
C499754	CCOC(=O)c1nc(I)c2n1CCCC2
C499755	O=Cc1cc(Cl)c2cc[nH]c2c1
C499757	Nc1ccnc(-c2ccccc2)c1F
C499758	COC(=O)CCc1[nH]cc(C)c1C
C499761	CCOC(=O)C12CC(CI)(C1)OC2c1cnn(-c2ccccc2)n1
C499763	CCC(=O)CCS
C499766	CS(=O)(=O)c1ccc(S)c(N)c1
C499767	COc1cc(C#N)cc(F)c1C=O
C499769	Cc1ccc(OCCCN)cc1[N+](=O)[O-]
C499774	CC(=O)c1cc(Cl)c(F)cc1Cl
C499775	NCCC(F)(F)c1ccncc1
C499776	NCCOCCOCCOCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
C499777	COc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2N
C499780	O=S(=O)(SC(F)(F)F)C(F)(F)F
C499785	O=C1NCC2CC1O2
C499786	O=C(Cl)N1CCSC1
C499787	CC1CNC(=O)CC(c2ccccc2)C=CCOc2ccccc2C(=O)N1
C499791	Ic1cncc2ncoc12
C499792	C#CC12CN(C(=O)OC(C)(C)C)C(C(=O)O)(C1)C2
C499793	[N-]=[N+]=NCc1cc(OS(=O)(=O)F)cc(C(=O)O)c1
C499795	CC(C)(C)[Si](C)(C)Oc1cccc(CCBr)c1
C499796	CC(C)(CC1CCN(C(=O)OC(C)(C)C)C1)N=[N+]=[N-]
C499797	BrCC(Br)CC1(NCc2ccccc2)CCOCC1
C499799	O=S(=O)(Cl)c1cc(Cl)nc(I)c1F
C499800	CC1=CC(=O)NC1
C499801	O=C1CCC(N2C(=O)c3ccc(OCCCCCN4CCNCC4)cc3C2=O)C(=O)N1
C499803	NCC(C(=O)O)c1cc2ccccc2s1
C499804	Cc1ccc(Br)c2c1CN(C(=O)OC(C)(C)C)CC2
C499806	COCCOc1nc(C)cc(Cl)n1
C499810	CCC(CO)Nc1nc(Nc2ccc(-c3ccccn3)cc2)c2ncn(C(C)C)c2n1
C499811	Cc1sc(Br)cc1CN
C499813	[N-]=[N+]=NCc1cc(=O)n2cc(Br)ccc2n1
C499814	Cc1cc(C)n(-c2ccc(S(=O)[O-])nn2)n1
C499819	CCCC(C(=O)O)S(=O)CCC(C)C
C499824	COc1ccc(Cl)c(F)c1NC(=O)OC(C)(C)C