| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 32 | No |
Popular Name: (9aS)-N-[(2R)-2-hydroxy-2-phenyl-ethyl]-1-(p-tolyl)-9aH-pyrido[3,4-b]indole-3-carboxamide (9aS)-N-[(2R)-2-hydroxy-2-phenyl…
| 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) | 4.23 | 8.61 | -31.8 | 3 | 5 | 1 | 76 | 422.508 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.23 | 8.98 | -93.32 | 4 | 5 | 2 | 77 | 423.516 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
