| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 37 | No |
Popular Name: (9aS)-N-(1-benzyl-4-piperidyl)-1-(4-methoxyphenyl)-9aH-pyrido[3,4-b]indole-3-carboxamide (9aS)-N-(1-benzyl-4-piperidyl)-1…
| 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) | 4.85 | 12.65 | -79.23 | 3 | 6 | 2 | 69 | 492.623 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.85 | 13.04 | -163.52 | 4 | 6 | 3 | 71 | 493.631 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
