COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565159
Chemical Name: 2-[(Z)-(4-ethyl-3,5-dimethyl-2H-pyrrol-2-ylidene)methyl]-3,4,5-trimethyl-1H-pyrrole
Smiles: CCC1=C(C)/C(=C/c2[nH]c(c(c2C)C)C)/N=C1C

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Saltdata: HBr
Molecular Weight: 242.36
Empirical Formula: C16H22N2

Physical State: Liquid
Available Amount: 55 mg

Lipinsky:
logP: 3.629
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 28
Number of rings: 2

     

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