UCSF

ZINC62912476

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 18th, 2011 19 Yes

Popular Name: 3-[[(3R)-3-ethylpyrrolidin-3-yl]methyl]-3-azaspiro[5.5]undecane 3-[[(3R)-3-ethylpyrrolidin-3-yl]…

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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) 3.60 8.72 -103.63 3 2 2 21 266.473 3 ↓
Mid Mid (pH 6-8) 3.60 7.09 -37.99 2 2 1 20 265.465 3 ↓

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

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