COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323043
Chemical Name: 7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C/Cn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C)/Cl

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Molecular Weight: 413.82
Empirical Formula: C18H16ClN7O3

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 2.999
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 120
Number of rings: 4

     

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