| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 21 | Yes |
Popular Name: (2S)-N-(1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-ylmethyl)-4-pyrazol-1-yl-butan-2-amine (2S)-N-(1,4,5,6,7,8-hexahydrocyc…
| 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) | 2.47 | 6.75 | -45.03 | 3 | 5 | 1 | 63 | 288.419 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 5.55 | -9.24 | 2 | 5 | 0 | 59 | 287.411 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole](http://zinc12.docking.org/img/rings/11870.gif)
![1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-ylmethyl(3-pyrazol-1-ylpropyl)amine](http://zinc12.docking.org/img/rings/602723.gif)