COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK645272
Chemical Name: ethyl4-(3-chlorobenzyl)-5-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]-2-methyl-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)c1c(C)[nH]c(c1Cc1cccc(c1)Cl)/C=C/1\C(=NC(=NC1=O)O)O

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Molecular Weight: 415.83
Empirical Formula: C20H18ClN3O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 4.653
Rotatable bonds: 8
H-donors: 3
H-acceptors: 5
PSA: 124
Number of rings: 3

     

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