| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2010 | 28 | Yes |
Popular Name: 4-[(9aS)-1,3,4,9a-tetrahydropyrido[3,4-b]indol-2-yl]-4-oxo-N-[2-(3-pyridyl)ethyl]butanamide 4-[(9aS)-1,3,4,9a-tetrahydropyri…
| 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) | 1.71 | 7.78 | -15.44 | 2 | 6 | 0 | 78 | 376.46 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | 8.24 | -44.09 | 3 | 6 | 1 | 79 | 377.468 | 6 | ↓ |
