UCSF

ZINC69067845

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2011 25 Yes

Popular Name: 1-[[[(1S)-1-(2-furyl)ethyl]-methyl-amino]methyl]-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one 1-[[[(1S)-1-(2-furyl)ethyl]-meth…

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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) 2.01 9.41 -13.71 0 7 0 69 337.383 4 ↓
Mid Mid (pH 6-8) 2.01 11.67 -47.94 1 7 1 70 338.391 4 ↓

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

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