COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK592123
Chemical Name: (2E)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-(diphenylmethyl)-3-hydroxybut-2-en-1-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)/C(=C(/O)\C)/C(c1ccccc1)c1ccccc1

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Molecular Weight: 443.54
Empirical Formula: C28H29NO4

Physical State: Dry powder
Available Amount: 273 mg

Lipinsky:
logP: 5.654
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 59
Number of rings: 4

     

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