UCSF

ZINC40769312

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 21 Yes

Popular Name: (1R,5S)-7-isopropyl-N-[(2-methylpyrimidin-4-yl)methyl]-7-azabicyclo[3.3.1]nonan-9-amine (1R,5S)-7-isopropyl-N-[(2-methyl…

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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) 2.10 8.32 -107.73 3 4 0 47 290.455 4 ↓
Hi High (pH 8-9.5) 2.10 7.22 -70.73 2 4 0 42 289.447 4 ↓
Hi High (pH 8-9.5) 2.10 8.1 -41.25 2 4 1 46 289.447 4 ↓

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

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