COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK620650
Chemical Name: methyl3-(3-{(Z)-[1-(4-butylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Smiles: CCCCc1ccc(cc1)N1C(=NC(=O)/C(=C/c2cc(n(c2C)c2cccc(c2)C(=O)OC)C)/C1=O)S

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Molecular Weight: 515.63
Empirical Formula: C29H29N3O4S

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 7.515
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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