COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533104
Chemical Name: 2-{[(2E)-3-(4-chlorophenyl)-2-{[(4-methylphenyl)carbonyl]amino}prop-2-enoyl]amino}octanoicacid
Smiles: CCCCCCC(C(=O)O)NC(=O)/C(=C\c1ccc(cc1)Cl)/NC(=O)c1ccc(cc1)C

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Molecular Weight: 456.97
Empirical Formula: C25H29ClN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.642
Rotatable bonds: 9
H-donors: 3
H-acceptors: 4
PSA: 95
Number of rings: 2

     

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