In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 20 | Yes |
Popular Name: (2R)-1-phenoxy-N-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)propan-2-amine (2R)-1-phenoxy-N-(1,4,5,6-tetrah…
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) | 2.79 | 6.73 | -37.62 | 3 | 4 | 1 | 55 | 272.372 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 5.52 | -7.64 | 2 | 4 | 0 | 50 | 271.364 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.