COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK579674
Chemical Name: 2-[4-(difluoromethoxy)-3-methoxyphenyl]-4-imino-6,7,11,12-tetrahydro-4H,10H-[1,4]dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-3-carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccc(c(c1)OC)OC(F)F

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Molecular Weight: 465.46
Empirical Formula: C25H21F2N3O4

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 3.734
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 5

     

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