UCSF

ZINC70096860

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2011 19 Yes

Popular Name: (1R,5S)-N-propyl-N-(pyrimidin-4-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-N-propyl-N-(pyrimidin-4-…

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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) 1.49 7.14 -36.19 2 4 1 46 261.393 5 ↓
Lo Low (pH 4.5-6) 1.49 7.31 -106.52 3 4 2 47 262.401 5 ↓

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

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