COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK165347
Chemical Name: methyl(4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-4-[4-(prop-2-en-1-yloxy)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: C=CCOc1ccc(cc1)/C=C\1/C(=C(N(C1=O)CCc1ccc(c(c1)OC)OC)C)C(=O)OC

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Molecular Weight: 463.53
Empirical Formula: C27H29NO6

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 4.738
Rotatable bonds: 9
H-donors: 0
H-acceptors: 6
PSA: 74
Number of rings: 3

     

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