COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147337
Chemical Name: 5-(3,4-dichlorophenyl)-4-hydroxy-1,3-dimethyl-2,6-dioxo-2,3,5,6-tetrahydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidin-11-ium
Smiles: Clc1cc(ccc1Cl)C1c2c(O)n(C)c(=O)n(c2=[NH+]C2=C1C(=O)c1c2cccc1)C

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Saltdata: CH3COO-
Molecular Weight: 441.29
Empirical Formula: C22H16Cl2N3O3

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 3.97
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 74
Number of rings: 5

     

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