COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL329125
Chemical Name: 3-imino-5,7-dimethyl-4a,7a-diphenyloctahydro-6H-imidazo[4,5-e][1,2,4]triazin-6-one
Smiles: N=C1NNC2(C(N1)(c1ccccc1)N(C)C(=O)N2C)c1ccccc1

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Saltdata: HCl
Molecular Weight: 336.4
Empirical Formula: C18H20N6O

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 2.988
Rotatable bonds: 0
H-donors: 4
H-acceptors: 1
PSA: 83
Number of rings: 4

     

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