COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197121
Chemical Name: N-{(E)-[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-benzodioxol-5-amine
Smiles: Clc1cccc(c1)n1c(C)cc(c1C)/C=N/c1ccc2c(c1)OCO2

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Molecular Weight: 352.82
Empirical Formula: C20H17ClN2O2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 4.687
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 35
Number of rings: 4

     

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