COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586596
Chemical Name: (2Z)-1-(4-chlorophenyl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanone
Smiles: Clc1ccc(cc1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2

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Molecular Weight: 327.77
Empirical Formula: C18H14ClNO3

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.354
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 4

     

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