COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK947614
Chemical Name: methyl3-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-4-(4-methylpiperazin-1-yl)benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)c1sc2c(c1Cl)cccc2)N1CCN(CC1)C

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Molecular Weight: 443.95
Empirical Formula: C22H22ClN3O3S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 4.791
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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