UCSF

ZINC37718965

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2009 18 Yes

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

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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) 2.69 7.45 -32.1 2 2 1 16 245.39 3 ↓
Mid Mid (pH 6-8) 2.69 6.29 -39.3 2 2 1 20 245.39 3 ↓
Lo Low (pH 4.5-6) 2.69 8.64 -105.23 3 2 2 21 246.398 3 ↓

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

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