UCSF

ZINC37179359

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 15 Yes

Popular Name: (1S,5R)-N-(cyclobutylmethyl)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (1S,5R)-N-(cyclobutylmethyl)-8-m…

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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) 1.94 5.43 -33.36 2 2 1 20 209.357 3 ↓
Mid Mid (pH 6-8) 1.94 7.79 -97.38 3 2 2 21 210.365 3 ↓

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Rings

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

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