COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK329215
Chemical Name: N-(4-{1-[2-(3,4-dichlorophenyl)-2-oxoethyl]pyridin-4(1H)-ylidene}cyclohexa-2,5-dien-1-ylidene)-N-methylmethanaminium
Smiles: C[N+](=C1C=C/C(=c/2\ccn(cc2)CC(=O)c2ccc(c(c2)Cl)Cl)/C=C1)C

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Saltdata: Br-
Molecular Weight: 386.3
Empirical Formula: C21H19Cl2N2O

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 23
Number of rings: 3

     

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