COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK763355
Chemical Name: 1,1'-{2-(3,4-dimethoxyphenyl)-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)c1ccc(c(c1)OC)OC

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Molecular Weight: 453.54
Empirical Formula: C26H31NO6

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 3.492
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 94
Number of rings: 3

     

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