| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 17 | Yes |
Popular Name: N-[(1S)-1-[4-(aminomethyl)phenyl]ethyl]pyridazin-3-amine N-[(1S)-1-[4-(aminomethyl)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) | 1.33 | 3.94 | -50.39 | 4 | 4 | 1 | 65 | 229.307 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 3.54 | -9.12 | 3 | 4 | 0 | 64 | 228.299 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 4.11 | -84.68 | 5 | 4 | 2 | 67 | 230.315 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 4.11 | -83.79 | 5 | 4 | 2 | 67 | 230.315 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
