UCSF

ZINC65528052

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 26 Yes

Popular Name: [(2S)-2-(3,5-dimethylisoxazol-4-yl)pyrrolidin-1-yl]-(5-isopropyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyraz [(2S)-2-(3,5-dimethylisoxazol-4-…

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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) 1.48 8.84 -54.53 1 7 1 69 358.466 3 ↓
Mid Mid (pH 6-8) 1.48 6.64 -15.35 0 7 0 67 357.458 3 ↓

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

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