TCMDC-138125
FEATURES
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NAMES
  • TCMDC-138125
SMILES
CS(=O)(=O)CCNC(=O)c1ccc(-c2cc3c(Nc4ccc5c(cnn5Cc5ccccc5)c4)ncnc3cn2)o1.Cl
InChI
InChI=1S/C29H25N7O4S.ClH/c1-41(38,39)12-11-30-29(37)27-10-9-26(40-27)23-14-22-24(16-31-23)32-18-33-28(22)35-21-7-8-25-20(13-21)15-34-36(25)17-19-5-3-2-4-6-19;/h2-10,13-16,18H,11-12,17H2,1H3,(H,30,37)(H,32,33,35);1H
MOLECULAR FORMULA
C29H26ClN7O4S
CROSS REFERENCES
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TCMDC-138125
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight603.15
AlogP4.62
HBond donors2
HBond acceptors11
Atoms68
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-138125.