In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 21 | Yes |
Popular Name: (1R,5S)-7-isopropyl-N-[(1S)-1-methyl-2-pyrazol-1-yl-ethyl]-7-azabicyclo[3.3.1]nonan-9-amine (1R,5S)-7-isopropyl-N-[(1S)-1-me…
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) | 2.70 | 9.34 | -109.63 | 3 | 4 | 0 | 39 | 292.471 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 8.44 | -3.74 | 2 | 4 | 0 | 34 | 291.463 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 8.97 | -31.1 | 2 | 4 | 1 | 38 | 291.463 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.