COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL447399
Chemical Name: N~2~-benzyl-N-(4-methylphenyl)-N~2~-[(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]isovalinamide
Smiles: CCC(N(C(=O)CSc1[nH]ncn1)Cc1ccccc1)(C(=O)Nc1ccc(cc1)C)C

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Molecular Weight: 437.57
Empirical Formula: C23H27N5O2S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 4.517
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 116
Number of rings: 3

     

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