TCMDC-131873
FEATURES
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NAMES
  • TCMDC-131873
SMILES
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cccc(-c2cccc(NC(=O)[C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)c2)c1
InChI
InChI=1S/C40H46N4O6/c1-39(2,3)49-37(47)43-33(23-27-15-9-7-10-16-27)35(45)41-31-21-13-19-29(25-31)30-20-14-22-32(26-30)42-36(46)34(24-28-17-11-8-12-18-28)44-38(48)50-40(4,5)6/h7-22,25-26,33-34H,23-24H2,1-6H3,(H,41,45)(H,42,46)(H,43,47)(H,44,48)/t33-,34-/m0/s1
MOLECULAR FORMULA
C40H46N4O6
CROSS REFERENCES
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TCMDC-131873
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight678.34
AlogP7.50
HBond donors4
HBond acceptors10
Atoms96
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-131873.