| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2009 | 18 | Yes |
Popular Name: N-butyl-4-[(isopropylamino)methyl]-N,2,5-trimethyl-pyrazol-3-amine N-butyl-4-[(isopropylamino)methy…
| 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) | 2.43 | 7.95 | -36.83 | 2 | 4 | 1 | 38 | 253.414 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 6.76 | -4.39 | 1 | 4 | 0 | 33 | 252.406 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.43 | 8.09 | -90.95 | 3 | 4 | 2 | 39 | 254.422 | 7 | ↓ |
