COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK605976
Chemical Name: 6-[(2Z)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)acetyl]pyridazin-3(2H)-one
Smiles: O=C(c1ccc(=O)[nH]n1)/C=C/1\NCCc2c1cc1OCCCOc1c2

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Molecular Weight: 339.35
Empirical Formula: C18H17N3O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 1.261
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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