COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK115577
Chemical Name: methyl4-[({[4-ethyl-5-({[(4-methoxyphenyl)carbonyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1ccc(cc1)C(=O)NCc1nnc(n1CC)SCC(=O)Nc1ccc(cc1)C(=O)OC

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Molecular Weight: 483.55
Empirical Formula: C23H25N5O5S

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 3.869
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 149
Number of rings: 3

     

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