UCSF

ZINC62619656

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2011 17 Yes

Popular Name: (1S,5R)-8-(2-morpholinoethyl)-8-azabicyclo[3.2.1]octan-3-ol (1S,5R)-8-(2-morpholinoethyl)-8-…

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Download: MOL2 SDF SMILES Flexibase

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) 0.35 1.95 -32.79 2 4 1 37 241.355 3 ↓
Hi High (pH 8-9.5) 0.35 -0.24 -3.32 1 4 0 36 240.347 3 ↓
Lo Low (pH 4.5-6) 0.35 4.21 -108.39 3 4 2 38 242.363 3 ↓

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Rings

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

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