KMI-569
FEATURES
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NAMES
  • KMI-569
SMILES
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)Nc1cccc(-c2nn[nH]n2)c1
InChI
InChI=1S/C33H45N9O7/c1-18(2)15-25(37-32(48)27(19(3)4)38-30(46)23(34)13-14-26(43)44)31(47)36-24(16-20-9-6-5-7-10-20)28(45)33(49)35-22-12-8-11-21(17-22)29-39-41-42-40-29/h5-12,17-19,23-25,27-28,45H,13-16,34H2,1-4H3,(H,35,49)(H,36,47)(H,37,48)(H,38,46)(H,43,44)(H,39,40,41,42)/t23-,24-,25-,27-,28+/m0/s1
MOLECULAR FORMULA
C33H45N9O7
CROSS REFERENCES
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KMI-569
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight679.34
AlogP0.76
HBond donors9
HBond acceptors16
Atoms94
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by KMI-569.