COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122419
Chemical Name: 2-({[5-(3-methylphenyl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Smiles: Cc1cccc(c1)c1nnc(n1C(C)C)SCc1nc2ccccc2c(=O)[nH]1

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Molecular Weight: 391.5
Empirical Formula: C21H21N5OS

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 4.833
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 97
Number of rings: 4

     

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