UCSF

ZINC67934843

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 26 Yes

Popular Name: [(3R)-1-ethylpyrrolidin-3-yl]-[3-(3-methoxyphenyl)-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl]metha [(3R)-1-ethylpyrrolidin-3-yl]-[3…

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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) 2.37 8.59 -53.54 1 6 1 60 356.446 4 ↓
Hi High (pH 8-9.5) 2.37 6.23 -15.49 0 6 0 59 355.438 4 ↓

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

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