In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: [2-(4-ethyl-4-methyl-1-piperidyl)indan-2-yl]methanamine [2-(4-ethyl-4-methyl-1-piperidyl…
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) | 2.90 | 8.43 | -116.96 | 4 | 2 | 2 | 32 | 274.452 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 6.39 | -39.93 | 3 | 2 | 1 | 31 | 273.444 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 8 | -30.93 | 3 | 2 | 1 | 30 | 273.444 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.