COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK421409
Chemical Name: methyl2-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCC(C2)C)NC(=O)c1sc2c(c1Cl)cccc2

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Molecular Weight: 419.95
Empirical Formula: C20H18ClNO3S2

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 8.468
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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