COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK395988
Chemical Name: N,N-bis(cyanomethyl)-1,3-benzodioxole-5-carboxamide
Smiles: N#CCN(C(=O)c1ccc2c(c1)OCO2)CC#N

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Molecular Weight: 243.22
Empirical Formula: C12H9N3O3

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: -0.802
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 86
Number of rings: 2

     

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