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Metallopeptide
FEATURES
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NAMES
  • Metallopeptide
SMILES
CC[C@@H](C)[C@H]1C(=O)N2[C@@H](CCCCNC(=O)C34CC5CC(CC(C5)C3)C4)C(=O)N3[C@H](C(=O)N[C@H](C=O)C(C)C)CS[Re]23(=O)N1Cc1ccccc1
InChI
InChI=1S/C38H58N5O5S.O.Re/c1-5-25(4)33(40-21-26-11-7-6-8-12-26)36(47)41-30(34(45)43-32(23-49)35(46)42-31(22-44)24(2)3)13-9-10-14-39-37(48)38-18-27-15-28(19-38)17-29(16-27)20-38;;/h6-8,11-12,22,24-25,27-33H,5,9-10,13-21,23H2,1-4H3,(H5,39,41,42,43,45,46,47,48,49);;/q-1;;+4/p-3/t25-,27?,28?,29?,30+,31-,32+,33+,38?;;/m1../s1
MOLECULAR FORMULA
C38H55N5O6ReS
CROSS REFERENCES
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Metallopeptide

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 896.34
AlogP 4.61
HBond donors 2
HBond acceptors 11
Atoms 106
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Metallopeptide.