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TCMDC-131869
FEATURES
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NAMES
  • TCMDC-131869
SMILES
CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(Cc2ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc2)cc1
InChI
InChI=1S/C35H52N4O6/c1-22(2)19-28(38-32(42)44-34(5,6)7)30(40)36-26-15-11-24(12-16-26)21-25-13-17-27(18-14-25)37-31(41)29(20-23(3)4)39-33(43)45-35(8,9)10/h11-18,22-23,28-29H,19-21H2,1-10H3,(H,36,40)(H,37,41)(H,38,42)(H,39,43)/t28-,29-/m1/s1
MOLECULAR FORMULA
C35H52N4O6
CROSS REFERENCES
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TCMDC-131869

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 624.39
AlogP 7.03
HBond donors 4
HBond acceptors 10
Atoms 97
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-131869.