| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2011 | 21 | Yes |
Popular Name: 3-(4-aminophenyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one 3-(4-aminophenyl)-1,2,3,4,5,6-he…
| 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) | 1.64 | 6.7 | -15.4 | 2 | 4 | 0 | 51 | 281.359 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 7.55 | -40.9 | 3 | 4 | 1 | 52 | 282.367 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
