COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL120596
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Smiles: N#Cc1c(NC(=O)c2ccc3c(c2)OCCCO3)sc2c1CCCC2

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Molecular Weight: 354.43
Empirical Formula: C19H18N2O3S

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 4.674
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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