| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | Yes |
Popular Name: N-ethyl-2,5-dimethyl-4-[[4-[(1S)-1-methylpropyl]piperazin-1-yl]methyl]pyrazol-3-amine N-ethyl-2,5-dimethyl-4-[[4-[(1S)…
| 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) | 1.80 | 6.12 | -35.36 | 2 | 5 | 1 | 38 | 294.467 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 4.21 | -5.67 | 1 | 5 | 0 | 36 | 293.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 6.25 | -74.19 | 3 | 5 | 2 | 39 | 295.475 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
