COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528699
Chemical Name: 3-(4-chlorophenyl)-2,6-dioxo-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium-1-yl)-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: Clc1ccc(cc1)n1c(=O)[nH]c(=O)c(c1[O-])C1[NH2+]CCc2c1[nH]c1c2cccc1

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Molecular Weight: 408.84
Empirical Formula: C21H17ClN4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.527
Rotatable bonds: 1
H-donors: 4
H-acceptors: 3
PSA: 104
Number of rings: 5

     

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