| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 28 | Yes |
Popular Name: N-[2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]ethyl]-1H-indazole-3-carboxamide N-[2-[4-[(4-fluorophenyl)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) | 2.54 | 6.66 | -48.11 | 3 | 6 | 1 | 65 | 382.463 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 4.4 | -11.13 | 2 | 6 | 0 | 64 | 381.455 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 6.67 | -46.73 | 3 | 6 | 1 | 65 | 382.463 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US6096746 | IBM Patent Data |
