COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL328024
Chemical Name: N-[(2Z)-3-(1,3-benzodioxol-5-yl)-2-{[(2-methoxyphenyl)carbonyl]amino}prop-2-enoyl]leucine
Smiles: COc1ccccc1C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)NC(C(=O)O)CC(C)C

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Molecular Weight: 454.48
Empirical Formula: C24H26N2O7

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 3.262
Rotatable bonds: 9
H-donors: 3
H-acceptors: 7
PSA: 123
Number of rings: 3

     

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