COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114555
Chemical Name: ethyl4-[({[5-({[(3,4-dimethoxyphenyl)carbonyl]amino}methyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC)CNC(=O)c1ccc(c(c1)OC)OC

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Molecular Weight: 527.6
Empirical Formula: C25H29N5O6S

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 3.943
Rotatable bonds: 11
H-donors: 2
H-acceptors: 6
PSA: 158
Number of rings: 3

     

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