UCSF

ZINC70188568

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 20 Yes

Popular Name: 5-[[4-(2-aminoethyl)-1-piperidyl]methyl]-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one 5-[[4-(2-aminoethyl)-1-piperidyl…

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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) 0.04 6.18 -104.5 4 7 1 98 277.352 4 ↓
Hi High (pH 8-9.5) 0.04 3.92 -76.66 3 7 0 97 276.344 4 ↓

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

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