TCMDC-132413
FEATURES
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NAMES
  • TCMDC-132413
SMILES
CCNc1cc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CNCc2cccc(OC)c2C)cc(N2CCCCS2(=O)=O)c1.O=CO
InChI
InChI=1S/C32H42N4O5S.CH2O2/c1-4-34-27-18-26(19-28(20-27)36-15-8-9-16-42(36,39)40)32(38)35-29(17-24-11-6-5-7-12-24)30(37)22-33-21-25-13-10-14-31(41-3)23(25)2;2-1-3/h5-7,10-14,18-20,29-30,33-34,37H,4,8-9,15-17,21-22H2,1-3H3,(H,35,38);1H,(H,2,3)/t29-,30+;/m0./s1
MOLECULAR FORMULA
C33H44N4O7S
CROSS REFERENCES
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TCMDC-132413
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight640.29
AlogP3.56
HBond donors5
HBond acceptors11
Atoms89
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-132413.