COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK266203
Chemical Name: 4-ethoxy-N-[(4-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(cc1)C

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Molecular Weight: 547.63
Empirical Formula: C28H29N5O5S

Physical State: Dry powder
Available Amount: 492 mg

Lipinsky:
logP: 3.168
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 151
Number of rings: 4

     

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