COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK463673
Chemical Name: 6-({4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}carbonyl)-3,4-dimethylcyclohex-3-ene-1-carboxylicacid
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)C1CC(=C(CC1C(=O)O)C)C

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Molecular Weight: 440.95
Empirical Formula: C20H25ClN2O5S

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 3.726
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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