Compound List

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Compound	Smiles	Mol
C497846	CCOC(=O)c1c(-c2ccccc2)[nH]c(Cc2[nH]c(-c3ccccc3)c(C(=O)OCC)c2Cc2cccc(Cl)c2)c1Cc1cccc(Cl)c1
C497847	O=C(CCl)Nc1ccc(Cl)cc1I
C497848	CCCCN(C)S(=O)(=O)c1cccc(N)c1
C497850	CS(=O)(=O)c1coc(C=O)c1
C497852	NC(c1ccccc1Br)C(F)F
C497854	CC1CCCN(C(=O)c2onc3ccccc23)C1CCCN
C497856	COC(=O)c1cc(N)c(N)nc1OC
C497857	O=Cc1ccn(-c2ccnc(Cl)c2)n1
C497858	CCOC(=O)C(O)C(C)(C)C#N
C497859	CC(C)(C)OC(=O)Nc1cc(Cl)c(Cl)nc1Cl
C497863	O=C1OC(=O)C23CCCCC12C3
C497865	COC(=O)c1c(F)cc(C(F)(F)F)cc1Br
C497866	O=C(O)c1cnn2cc(Br)ccc12
C497867	COc1ccc(C(=O)C=Cc2ccc(O)c([N+](=O)[O-])c2)c(OC)c1
C497868	NCc1nnc2cc(C(F)(F)F)ccn12
C497869	O=C(O)c1ccc(F)c2nc[nH]c12
C497870	COc1cccc2c(N3CCC(CCP(=O)(O)O)CC3)ncnc12
C497871	O=C(O)c1cc(=O)[nH]c2c1c(C1CC1)nn2-c1ccc(F)cc1
C497874	CC(C)C1=CCC(C)(O)CC1
C497876	O=C(O)C1CCNCC1c1cn[nH]c1
C497877	Cc1c2cn[nH]c(=O)c2c(C)n1-c1ccccc1
C497882	CC(C)(C)c1ccc(OC(=O)C23CC(I)(C2)C3)cc1
C497884	COc1ccc(C=O)cc1COc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
C497885	O=S(=O)(Cl)c1c(Br)cc(Cl)c2ncccc12
C497886	NC(c1ccc([N+](=O)[O-])c(O)c1)C(F)(F)F
C497887	CC(Cc1cnco1)C(=O)O
C497888	CCOC(=O)c1ccc(Br)cc1C(C)=O
C497892	COc1cc(C(C)=O)ccc1COc1ccc(C=O)cc1OC
C497894	Cc1c(I)nc2n1CCCC2
C497895	CC(C)(C)OC(=O)NC1CCN(c2nccc(Cl)n2)CC1
C497897	COC(=O)CC1C(O)CC1OC(C)(C)C
C497898	C=C1CC(C(N=[N+]=[N-])C(F)F)C1
C497902	O=Cc1cccc(Oc2cccc(F)c2)c1
C497903	Oc1cccc(CCc2ccccc2)c1
C497907	O=S(=O)(F)Oc1cccc2ccccc12
C497908	CC(C)(C)OC(=O)N1CC(OCc2ccccc2)CC1CC(=O)O
C497910	OC(CCN1CCN(c2cccc3[nH]ccc23)CC1)c1csc2ccccc12
C497911	CCOC(=O)C(N)Cc1nnc(C)s1
C497912	O=C(c1ccccc1)N1CC2C(C1)C2(F)F
C497914	Cc1ccc(CC2CCCC2N)cc1
C497918	NCC(=O)c1ccc(C(=O)Oc2ccccc2)cc1
C497919	COc1ccc(Nc2cc(F)nc(F)c2)nc1C(=O)NC1CCC1(C)C
C497920	O=S1(=O)NC=Cc2ccccc21
C497921	COC(=O)C12CCC(C=Cc3ccccc3)(CC1)CN2C(=O)OC(C)(C)C
C497924	Cn1cc(Br)nc1C1(OCC(=O)O)CCN(C(=O)OCC2c3ccccc3-c3ccccc32)CC12CCOCC2
C497925	COC(=O)c1ccsc1C(C)(F)F
C497926	COCC1(C(=O)[O-])CCN(Cc2ccccc2)CC1
C497927	CC(C)(C)Cc1nc2ccccc2[nH]1
C497930	CC(C)(C)OC(=O)N1CCC(O)(C2CCNCC2)C1
C497931	CC(=O)SCCC1(C#N)CCN(C(=O)OC(C)(C)C)CC1
C497932	NC1C2CCC3(COC(=O)C13)O2
C497934	O=C1NCCCN1C1CNC1
C497935	O=C(O)Cc1c[nH]c2cccc(F)c12
C497936	COc1cc(C(C[N+](=O)[O-])c2c(N)n(C)c(=O)n(C)c2=O)ccc1OCc1ccccc1
C497937	O=S(=O)(O)c1cccc(Br)c1
C497938	COC(=O)c1ncc2c(=O)[nH]ccn12
C497940	C=CC(=O)NC1CC(c2cccc(C)c2)C1
C497941	NC(=S)c1cccc2c1OCC2
C497943	Cn1cc(C2CN(C(=O)c3cc(-c4ccc(Cl)cc4)on3)CC2N)cn1
C497944	CNS(=O)(=O)c1ccc(B(O)O)cc1
C497945	O=C(CCCCl)Nc1ccc(Br)c(F)c1
C497946	O=C(O)CCCc1cc(Cl)ccc1Cl
C497947	CCS(=O)(=O)c1nc(-c2cn(C)nc2C)cc(C(F)F)n1
C497952	CCOC(=O)C(=O)C(C)(C)O
C497954	CN1CCC(CO)C1c1ccccc1
C497955	COc1ccc(NCc2cc(F)ccc2F)c(OC)c1
C497960	O=C(Nc1ccccc1)c1nnc(C(=O)Nc2ccccc2)s1
C497963	Cc1ccc(C(F)(F)F)cc1B1OC(C)(C)C(C)(C)O1
C497966	OCc1ccc(Br)nc1C1CC1
C497967	COC(=O)c1cc2ccoc2cn1
C497968	CC(C)(C)OC(=O)N1CC(C(=O)NCC(=O)O)C1
C497969	N#Cc1cc(F)c(C=O)cc1F
C497971	Cc1cccc(P(=O)(c2ccccc2)c2ccccc2)c1
C497973	CCOC(=O)C12CC(CI)(C1)OC2c1c(C)noc1C
C497976	CC(C)(C)OC(=O)N1CC2CCCC(C(=O)O)(C1)O2
C497978	CC(C)(C)OC(=O)NCC12CCC(N)(CC1)CC2
C497979	C#Cc1ccc(C=O)c(Cl)c1
C497980	CC(C)(C)c1cnc(CN2CCNCC2)o1
C497982	CC(C)(C)OC(=O)N1CC2(CN=[N+]=[N-])CC1C2
C497984	COc1cccc2c1C(N)CO2
C497987	Cc1cc(O)cc2c1NC(=O)CO2
C497988	Cc1cc(C(=O)NN)oc1C
C497989	CCOC(=O)C(=Cc1cccc(OC)c1)C(=O)OCC
C497991	COC(=O)Cn1cncc1Br
C497992	C#CCC1(CN)CC1
C497993	COCc1cncs1
C497994	CC(Cl)c1cccc(Oc2ccccc2)c1
C497995	COC1CCC2(CCNCC2)CC1
C497996	NCC12CC(C1)C(C(F)F)O2
C497998	O=C(O)c1cc2c(c(C(F)(F)F)c1)OCCO2
C497999	NCc1n[nH]c2cc(F)ccc12
C498000	Cn1c(N)nc2cc(C(F)(F)F)ccc21
C498001	Cc1ccnc(-n2ncc(CO)c2C)c1
C498007	O=C(O)Cn1nccc1Br
C498008	Cc1cc(S(N)(=O)=O)cnc1NN
C498009	CC(C)N1CCN(c2ncccn2)CC1
C498011	Cc1c(C(=O)CCl)cc(C#N)n1C
C498012	Nc1cc(Br)c2c(c1)NC(=O)CO2
C498014	C=C(CBr)c1cccc(Br)c1
C498016	O=S(=O)(c1cn[nH]c1)C(F)(F)F