COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK365093
Chemical Name: (2E)-2-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1c[nH]c2c1cccc2)/C(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 327.39
Empirical Formula: C21H17N3O

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 3.254
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 59
Number of rings: 4

     

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