COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443926
Chemical Name: (2Z)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1-butyl-1H-indol-3-yl)-2-cyanoprop-2-enamide
Smiles: CCCCn1cc(c2c1cccc2)/C=C(\C(=O)NCc1ccc2c(c1)OCO2)/C#N

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Molecular Weight: 401.47
Empirical Formula: C24H23N3O3

Physical State: Dry powder
Available Amount: 281 mg

Lipinsky:
logP: 4.875
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 76
Number of rings: 4

     

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