UCSF

ZINC53943715

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2010 21 Yes

Popular Name: (2S)-1-([1,2,4]triazolo[3,4-a]phthalazin-6-yl)pyrrolidine-2-carboxylic (2S)-1-([1,2,4]triazolo[3,4-a]ph…

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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) -0.23 10.29 -39.14 1 7 0 88 283.291 2 ↓
Mid Mid (pH 6-8) -0.23 9.47 -48.49 0 7 -1 86 282.283 2 ↓

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Rings

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

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