COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757518
Chemical Name: 3,4-dimethylphenyl5-(azepan-1-ylsulfonyl)-2-chlorobenzoate
Smiles: O=C(c1cc(ccc1Cl)S(=O)(=O)N1CCCCCC1)Oc1ccc(c(c1)C)C

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Molecular Weight: 421.94
Empirical Formula: C21H24ClNO4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.044
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 72
Number of rings: 3

     

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