COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK689937
Chemical Name: 2-amino-3-[(3,4-dimethoxyphenyl)carbonyl]-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carbonitrile
Smiles: COc1ccc(cc1OC)C(=O)c1n2CCCCCc2c(c1N)C#N

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Molecular Weight: 339.39
Empirical Formula: C19H21N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.598
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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