| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 17 | Yes |
Popular Name: 1-(4-ethyl-4-piperidyl)-N-[(5-methyl-2-thienyl)methyl]methanamine 1-(4-ethyl-4-piperidyl)-N-[(5-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) | 2.40 | 7.01 | -107.94 | 4 | 2 | 2 | 33 | 254.443 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 5.83 | -39.3 | 3 | 2 | 1 | 29 | 253.435 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
