| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: 1,3-dimethyl-5-[4-[(1S)-1-methylpropyl]piperazin-1-yl]pyrazol-4-amine 1,3-dimethyl-5-[4-[(1S)-1-methyl…
| 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) | 1.35 | 5.73 | -38.45 | 3 | 5 | 1 | 52 | 252.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.35 | 3.87 | -4.29 | 2 | 5 | 0 | 50 | 251.378 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 5.85 | -79.76 | 4 | 5 | 2 | 53 | 253.394 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
