COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295622
Chemical Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-[(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-ylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/N[C@]12CN3CN(C2)CN(C1)C3)c1ccc(c(c1)C)C

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Molecular Weight: 366.47
Empirical Formula: C20H26N6O

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 3.66
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 54
Number of rings: 6

     

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