COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541682
Chemical Name: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-8-ethyl-8-methyl-3-(4-methylphenyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCc1ccc2c(c1)OCO2)c1ccc(cc1)C

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Molecular Weight: 501.61
Empirical Formula: C28H27N3O4S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 5.272
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 98
Number of rings: 6

     

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