COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587276
Chemical Name: (2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1-(3-methylthiophen-2-yl)ethanone
Smiles: O=C(c1sccc1C)/C=C/1\NCCc2c1cc1OCOc1c2

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Molecular Weight: 313.38
Empirical Formula: C17H15NO3S

Physical State: Dry powder
Available Amount: 171 mg

Lipinsky:
logP: 3.653
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 75
Number of rings: 4

     

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