COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK462224
Chemical Name: 2-(1,3-benzodioxol-5-yl)-N-(3-carbamoyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide
Smiles: CCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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Molecular Weight: 499.59
Empirical Formula: C28H25N3O4S

Physical State: Dry powder
Available Amount: 534 mg

Lipinsky:
logP: 7.174
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 131
Number of rings: 6

     

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