COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580666
Chemical Name: (7-methylidene-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)(3-methylthiophen-2-yl)methanone
Smiles: C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1sccc1C

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Molecular Weight: 341.43
Empirical Formula: C19H19NO3S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.056
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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