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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02229206

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3DP3-(N,N-DIMETHYLOCTYLAMMONIO)PROPANESULFONATEA,B2FIM0.82
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
B1GZY0.83
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
A1X9T0.83
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
B1H020.83
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
B1GZZ0.83
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
A,B2VZ20.83
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
A1X9P0.83
C15N-DODECYL-N,N-DIMETHYL-3-AMMONIO-
1-PROPANESULFONATE
B1GZR0.83
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA2VW20.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1R6L0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B2D0U0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA3E9Y0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1L5B0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B3CGG0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA2QVN0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B1H9X0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1YI10.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B2VSY0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1P7J0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1YI00.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1Z8N0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B3GXZ0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1Q1Q0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B2D0T0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B3ESL0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1YHY0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,J3D3B0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA3GQ90.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1YBH0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B,C,D3G8W0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA3GQ80.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1P7I0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDC2CUK0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B2ITE0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B3GXY0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1YHZ0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1OKS0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDB1ZHH0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA3EA40.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B,C,D2DSY0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA,B2ICH0.85
NHE2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACIDA1V300.85
NDSETHYL DIMETHYL AMMONIO PROPANE SULFONATEA1U3D0.74
NDSETHYL DIMETHYL AMMONIO PROPANE SULFONATEA,B,C1TCV0.74
NDSETHYL DIMETHYL AMMONIO PROPANE SULFONATEA,B2V420.74
NDSETHYL DIMETHYL AMMONIO PROPANE SULFONATEA1U3C0.74
NDSETHYL DIMETHYL AMMONIO PROPANE SULFONATEA,B,C,D2NP50.74
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B,C,D2WAX0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDX1Z700.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B2DD70.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B2HL60.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDB2A260.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2FKA0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDH2VXV0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA1RZL0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2A320.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B1Y560.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDH,K,L,M,P,R1N0X0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B,C,D2BJ00.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2IMF0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2BK90.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2FLK0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2IME0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA2IMD0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B2IX90.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B,C,D2DD90.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDA,B,C,D,E,F,
G,H
2QGQ0.85
CXS3-CYCLOHEXYL-1-PROPYLSULFONIC ACIDX1Y1J0.85
NSBN,N,N-TRIMETHYL-3-SULFOPROPAN-1-
AMINIUM
A2A5X0.77