COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307830
Chemical Name: 2-{[5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxy-5-nitrophenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2CC2CCCO2)c2nn(cc2Cl)CC)cc(c1)[N+](=O)[O-]

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Molecular Weight: 521.98
Empirical Formula: C21H24ClN7O5S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 3.541
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 167
Number of rings: 4

     

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