| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: 4-(aminomethyl)-N,5,6-trimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]pyridazin-3-amine 4-(aminomethyl)-N,5,6-trimethyl-…
| 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) | 1.44 | 4.33 | -26.87 | 3 | 5 | 1 | 66 | 265.381 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.26 | -8.36 | 2 | 5 | 0 | 64 | 264.373 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 4.38 | -22.56 | 3 | 5 | 1 | 66 | 265.381 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 4.85 | -104.91 | 4 | 5 | 2 | 67 | 266.389 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 4.79 | -104.85 | 4 | 5 | 2 | 67 | 266.389 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
