COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139610
Chemical Name: propan-2-yl3-({[(4-ethyl-5-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Smiles: COc1cccc(c1)NC(=O)Cc1nnc(n1CC)SCC(=O)Nc1cccc(c1)C(=O)OC(C)C

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Molecular Weight: 511.6
Empirical Formula: C25H29N5O5S

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 4.643
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 149
Number of rings: 3

     

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