| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 21 | Yes |
Popular Name: 4-[(isopropylamino)methyl]-N,2,5-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-3-amine 4-[(isopropylamino)methyl]-N,2,5…
| 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) | 0.77 | 7.26 | -42.67 | 2 | 6 | 1 | 55 | 291.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | 6.03 | -8.57 | 1 | 6 | 0 | 51 | 290.415 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.77 | 7.4 | -96.68 | 3 | 6 | 2 | 57 | 292.431 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
