COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056062
Chemical Name: (5E)-3-(4-chlorophenyl)-5-(1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCCC2=CCCCC2)/C)/C1=O)O

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Molecular Weight: 387.87
Empirical Formula: C20H22ClN3O3

Physical State: Dry powder
Available Amount: 273 mg

Lipinsky:
logP: 4.287
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 82
Number of rings: 3

     

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