| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2009 | 19 | Yes |
Popular Name: N-[[1,3-dimethyl-5-(4-methylpiperazin-1-yl)pyrazol-4-yl]methyl]propan-2-amine N-[[1,3-dimethyl-5-(4-methylpipe…
| 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) | 0.89 | 7.37 | -96.48 | 3 | 5 | 2 | 42 | 267.421 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.89 | 3.76 | -4.1 | 1 | 5 | 0 | 36 | 265.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.89 | 5 | -36.31 | 2 | 5 | 1 | 41 | 266.413 | 4 | ↓ |
