UCSF

ZINC71551757

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 27 No

Popular Name: (3aS,6aR)-5-(1-ethylpyrazole-3-carbonyl)-3-(3-morpholinopropyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d]ox (3aS,6aR)-5-(1-ethylpyrazole-3-c…

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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) 0.16 4.28 -19.75 0 9 0 80 377.445 6 ↓
Mid Mid (pH 6-8) 0.16 6.54 -55.73 1 9 1 81 378.453 6 ↓

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

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