COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK600700
Chemical Name: 2-[4-(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCc2c(C1C)cc1c(c2)OCCCO1)CCCN1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 434.49
Empirical Formula: C25H26N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.03
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 76
Number of rings: 5

     

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