UCSF

ZINC11821561

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2008 25 No

Popular Name: (3aS,6aR)-5-(3-phenylpropyl)-3-(2-pyridylmethyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d]oxazol-2-one (3aS,6aR)-5-(3-phenylpropyl)-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) 2.47 0.34 -56.14 1 5 1 47 338.431 6 ↓
Lo Low (pH 4.5-6) 2.47 0.41 -103.11 2 5 2 48 339.439 6 ↓

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Rings

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

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