COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809461
Chemical Name: (2E)-2-(azepan-1-ylcarbonyl)-3-(3,4-dichlorophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)Cl)Cl)/C(=O)N1CCCCCC1

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Molecular Weight: 323.22
Empirical Formula: C16H16Cl2N2O

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 3.961
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 44
Number of rings: 2

     

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