| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 23 | Yes |
Popular Name: [4,6-bis(trifluoromethyl)-2-pyridinyl](4-methylpiperazino)methanone [4,6-bis(trifluoromethyl)-2-pyri…
Find On: PubMed — Wikipedia — Google
CAS Number: 1092345-42-0
| 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) | 2.68 | 5.08 | -4.75 | 0 | 4 | 0 | 36 | 341.255 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 7.48 | -41.06 | 1 | 4 | 1 | 38 | 342.263 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
