UCSF

ZINC69949568

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 27 No

Popular Name: (6R)-3-phenyl-6-(2-pyridyl)-6,7-dihydro-[1,2,4]triazino[2,3-c]quinazolin-2-one (6R)-3-phenyl-6-(2-pyridyl)-6,7-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.25 9.26 -27.49 2 6 1 78 354.393 2 ↓
Mid Mid (pH 6-8) 3.25 8.69 -84.91 3 6 2 79 355.401 2 ↓
Mid Mid (pH 6-8) 3.70 8.48 -20.71 1 6 0 81 353.385 2 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.