COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055800
Chemical Name: (5E)-5-[1-(azepan-1-ylamino)ethylidene]-3-(4-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NN2CCCCCC2)/C)/C1=O)O

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Molecular Weight: 376.84
Empirical Formula: C18H21ClN4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.481
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 85
Number of rings: 3

     

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