COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL010866
Chemical Name: 5-(1,3-benzodioxol-5-ylmethyl)-5-{[(4-chlorophenyl)amino]methyl}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)NCC1(Cc2ccc3c(c2)OCO3)C(=O)N(C)C(=O)N(C1=O)C

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N N O O O O O NH Cl
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Molecular Weight: 429.86
Empirical Formula: C21H20ClN3O5

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 2.127
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 88
Number of rings: 4

     

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