Compound Name

SMILES String

Brc1ccc(cc1)C(SCC(=O)NCCCc1ccccc1)c1ccc(Br)cc1

Brc1ccc(cc1)C(SCCNCCCc1ccccc1)c1ccc(Br)cc1

Brc1ccc(cc1)C(c1ccc(Br)cc1)S(=O)CCNCCCc1ccccc1

C(CN1CCN(CCSC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1

C(CNCCSC(c1ccccc1)c1ccccc1)Cc1ccccc1

C(CSC(c1ccccc1)c1ccccc1)NCC1CC1

C=CCNC(=O)CSC(c1ccccc1)c1ccccc1

CC(O)CN1CCN(CCS(=O)C(c2ccc(F)cc2)c2ccc(F)cc2)CC1

CC(O)CN1CCN(CCS(=O)C(c2ccccc2)c2ccccc2)CC1

CC(O)CN1CCN(CCSC(c2ccc(F)cc2)c2ccc(F)cc2)CC1

CC(O)CN1CCN(CCSC(c2ccccc2)c2ccccc2)CC1

CCCCNC(=O)CSC(c1ccc(Br)cc1)c1ccc(Br)cc1

CCCCNC(=O)CSC(c1ccc(F)cc1)c1ccc(F)cc1

CCCCNC(=O)CSC(c1ccccc1)c1ccccc1

CCCCNCCS(=O)C(c1ccccc1)c1ccccc1

CCCCNCCSC(c1ccccc1)c1ccccc1

CCCNC(=O)CSC(c1ccc(Br)cc1)c1ccc(Br)cc1

CCCNC(=O)CSC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

CCCNC(=O)CSC(c1ccc(F)cc1)c1ccc(F)cc1

CCCNC(=O)CSC(c1ccccc1)c1ccccc1

CCN(CC)CC1(CCCCC1)c1ccc(Cl)c(Cl)c1

CN(C)CC1(CCC(F)CC1)c1ccc(Cl)c(Cl)c1 |(2.1,-8.48,;1.11,-7.3,;-.41,-7.56,;1.64,-5.85,;.65,-4.67,;-.34,-5.85,;-1.86,-5.58,;-2.39,-4.13,;-3.9,-3.87,;-1.4,-2.95,;.12,-3.22,;1.98,-3.9,;3.31,-4.67,;4.65,-3.9,;4.65,-2.36,;5.98,-1.59,;3.31,-1.59,;3.31,-.05,;1.98,-2.36,)|

CN(C)CC1(CCC(O)CC1)c1ccc(Cl)c(Cl)c1 |(2.1,-8.48,;1.11,-7.3,;-.41,-7.56,;1.64,-5.85,;.65,-4.67,;-.34,-5.85,;-1.86,-5.58,;-2.39,-4.13,;-3.9,-3.87,;-1.4,-2.95,;.12,-3.22,;1.98,-3.9,;3.31,-4.67,;4.65,-3.9,;4.65,-2.36,;5.98,-1.59,;3.31,-1.59,;3.31,-.05,;1.98,-2.36,)|

CN(C)CC1(CCCC(O)C1)c1ccc(Cl)c(Cl)c1

CN(C)CC1(CCCCC1)c1ccc(Cl)c(Cl)c1

CN(C)CC1(CCCCC1)c1cccc2ccccc12

CN(C)CC1(CCCCC1O)c1ccc2ccccc2c1

CNC(=O)CS(=O)C(c1ccccc1)c1ccccc1

CNC(=O)CSC(c1ccc(Br)cc1)c1ccc(Br)cc1

CNC(=O)CSC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

CNC(=O)CSC(c1ccccc1)c1ccccc1

CNC(C)C1(CCCCC1)c1ccc(Cl)c(Cl)c1

CNC(C)C1(CCCCC1)c1ccc2ccccc2c1

CNCC1(CCC(C)(O)CC1)c1ccc(Cl)c(Cl)c1 |(6.04,-.6,;5.52,-2.04,;6.51,-3.22,;5.98,-4.67,;7.5,-4.94,;8.02,-6.38,;7.03,-7.56,;6.82,-9.09,;8.18,-8.59,;5.52,-7.3,;4.99,-5.85,;4.65,-3.9,;3.31,-4.67,;1.98,-3.9,;1.98,-2.36,;.65,-1.59,;3.31,-1.59,;3.31,-.05,;4.65,-2.36,)|

CNCC1(CCCCC1)c1ccc(Cl)c(Cl)c1

CNCC1(CCCCC1)c1cccc2ccccc12

COC1CCC(CN(C)C)(CC1)c1ccc(Cl)c(Cl)c1 |(-4.89,-5.05,;-3.9,-3.87,;-2.39,-4.13,;-1.86,-5.58,;-.34,-5.85,;.65,-4.67,;1.64,-5.85,;1.11,-7.3,;2.1,-8.48,;-.41,-7.56,;.12,-3.22,;-1.4,-2.95,;1.98,-3.9,;3.31,-4.67,;4.65,-3.9,;4.65,-2.36,;5.98,-1.59,;3.31,-1.59,;3.31,-.05,;1.98,-2.36,)|

Clc1ccc(cc1)C(SCC(=O)NCC1CC1)c1ccc(Cl)cc1

Clc1ccc(cc1)C(SCC(=O)NCCCc1ccccc1)c1ccc(Cl)cc1

Clc1ccc(cc1)C(c1ccc(Cl)cc1)S(=O)CCNCCCc1ccccc1

Fc1ccc(cc1)C(SCC(=O)NCC1CC1)c1ccc(F)cc1

Fc1ccc(cc1)C(SCC(=O)NCCCc1ccccc1)c1ccc(F)cc1

Fc1ccc(cc1)C(SCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1

Fc1ccc(cc1)C(SCCNCCCc1ccccc1)c1ccc(F)cc1

Fc1ccc(cc1)C(c1ccc(F)cc1)S(=O)CCN1CCN(CCCc2ccccc2)CC1

Fc1ccc(cc1)C(c1ccc(F)cc1)S(=O)CCNCCCc1ccccc1

NC(=O)CSC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

NC(=O)CSC(c1cccc(Cl)c1)c1cccc(Cl)c1

NC(=O)CSC(c1ccccc1)c1ccccc1

NCC1(CCCCC1)c1ccc(Cl)c(Cl)c1

NCC1(CCCCC1)c1cccc2ccccc12

NCCS(=O)C(c1ccccc1)c1ccccc1

NCCSC(c1ccc(Br)cc1)c1ccc(Br)cc1

NCCSC(c1ccc(Cl)cc1)c1ccc(Cl)cc1

NCCSC(c1ccccc1)c1ccccc1

O=C(CS(=O)C(c1ccccc1)c1ccccc1)N1CCN(CCCc2ccccc2)CC1

O=C(CSC(c1ccccc1)c1ccccc1)N1CCN(CCCc2ccccc2)CC1

O=C(CSC(c1ccccc1)c1ccccc1)NCC1CC1

O=C(CSC(c1ccccc1)c1ccccc1)NCCCCc1ccccc1

O=S(CCN1CCN(CCCc2ccccc2)CC1)C(c1ccccc1)c1ccccc1

O=S(CCNCCCc1ccccc1)C(c1ccccc1)c1ccccc1

OC(CN1CCN(CCS(=O)C(c2ccc(F)cc2)c2ccc(F)cc2)CC1)Cc1ccccc1

OC(CN1CCN(CCS(=O)C(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1

OC(CN1CCN(CCSC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)Cc1ccccc1

OC(CN1CCN(CCSC(c2ccccc2)c2ccccc2)CC1)Cc1ccccc1