COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK676380
Chemical Name: 2-[(4-benzyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)C)CSc1sc2c(n1)ccc(c2)NC(=O)CSc1nnc(n1Cc1ccccc1)c1ccccc1

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Molecular Weight: 671.27
Empirical Formula: C33H27ClN6O2S3

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 8.717
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 180
Number of rings: 6

     

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