COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK763356
Chemical Name: 1,1'-{2-(1,3-benzodioxol-5-yl)-6-hydroxy-4-[(4-methoxyphenyl)amino]-6-methylcyclohex-3-ene-1,3-diyl}diethanone
Smiles: COc1ccc(cc1)NC1=C(C(=O)C)C(C(C(C1)(C)O)C(=O)C)c1ccc2c(c1)OCO2

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Molecular Weight: 437.49
Empirical Formula: C25H27NO6

Available Amount: 0 mg

Lipinsky:
logP: 3.617
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 94
Number of rings: 4

     

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