COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK571125
Chemical Name: (3Z)-1,1-diphenyl-3-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)propan-2-one
Smiles: O=C(C(c1ccccc1)c1ccccc1)/C=C/1\NCCc2c1cc1OCCCOc1c2

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Molecular Weight: 411.5
Empirical Formula: C27H25NO3

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 5.504
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 5

     

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