COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122324
Chemical Name: (2E)-3-(2-chlorophenyl)-N-[(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]prop-2-enamide
Smiles: O=C(NCc1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1)/C=C/c1ccccc1Cl

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Molecular Weight: 466.95
Empirical Formula: C22H19ClN6O2S

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 3.056
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 126
Number of rings: 4

     

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