UCSF

ZINC67559342

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 28 Yes

Popular Name: (2R)-2-amino-1-(3-benzhydryl-6,7-dihydro-4H-isoxazolo[4,5-c]pyridin-5-yl)-3-hydroxy-propan-1-one (2R)-2-amino-1-(3-benzhydryl-6,7…

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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) 1.38 5.46 -51.85 4 6 1 94 378.452 5 ↓
Mid Mid (pH 6-8) 1.38 5.1 -14.86 3 6 0 93 377.444 5 ↓

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

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