| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 18 | Yes |
Popular Name: 4-[(isopropylamino)methyl]-N,2,5-trimethyl-N-[(1S)-1-methylpropyl]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) | 2.20 | 7.39 | -36.43 | 2 | 4 | 1 | 38 | 253.414 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 6.31 | -23.22 | 2 | 4 | 1 | 34 | 253.414 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 6.19 | -4.63 | 1 | 4 | 0 | 33 | 252.406 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 7.61 | -89.65 | 3 | 4 | 2 | 39 | 254.422 | 6 | ↓ |
