COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK116329
Chemical Name: (2E)-N-[4-(4-methyl-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]-3-phenylprop-2-enamide
Smiles: O=C(Nc1ccc(cc1)c1nnc(n1C)SCC(=O)N1CCCC1)/C=C/c1ccccc1

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Molecular Weight: 447.56
Empirical Formula: C24H25N5O2S

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 4.902
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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