UCSF

ZINC67541395

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 26 Yes

Popular Name: 3-(3-benzhydryl-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl)propan-1-ol 3-(3-benzhydryl-6,7-dihydro-4H-i…

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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) 3.47 9.95 -52.95 2 4 1 51 349.454 6 ↓
Mid Mid (pH 6-8) 3.47 7.71 -11.02 1 4 0 49 348.446 6 ↓

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

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