COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568226
Chemical Name: (5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-3-(4-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCc2ccc3c(c2)OCO3)/C)/C1=O)O

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Molecular Weight: 413.82
Empirical Formula: C20H16ClN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.111
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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