COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK134112
Chemical Name: N-{4-[4-benzyl-5-({1-[(4-ethoxyphenyl)amino]-1-oxopropan-2-yl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}-3-methylbenzamide
Smiles: CCOc1ccc(cc1)NC(=O)C(Sc1nnc(n1Cc1ccccc1)c1ccc(cc1)NC(=O)c1cccc(c1)C)C

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Molecular Weight: 591.73
Empirical Formula: C34H33N5O3S

Physical State: Dry powder
Available Amount: 344 mg

Lipinsky:
logP: 7.832
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 5

     

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