COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK433596
Chemical Name: methyl2-({[2-(1,3-benzodioxol-5-yl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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Molecular Weight: 486.55
Empirical Formula: C27H22N2O5S

Physical State: Dry powder
Available Amount: 213 mg

Lipinsky:
logP: 7.49
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 114
Number of rings: 6

     

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