COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113916
Chemical Name: N-{1-[5-({2-[(5-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-4-methylbenzamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1C)C(C(C)C)NC(=O)c1ccc(cc1)C

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Molecular Weight: 486.04
Empirical Formula: C24H28ClN5O2S

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 5.333
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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