| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 21 | Yes |
Popular Name: [2-chloro-6-(methylamino)-4-pyridyl]-[4-[(1R)-1-methylpropyl]piperazin-1-yl]methanone [2-chloro-6-(methylamino)-4-pyri…
| 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) | 1.93 | 4.47 | -8.2 | 1 | 5 | 0 | 48 | 310.829 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 6.31 | -45.74 | 2 | 5 | 1 | 50 | 311.837 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
