In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 21 | Yes |
Popular Name: 4-[[1-(1-ethylpropyl)pyrazol-3-yl]methyl]-2,3-dihydro-1H-quinoxaline 4-[[1-(1-ethylpropyl)pyrazol-3-y…
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) | 3.54 | 8.07 | -8.53 | 1 | 4 | 0 | 33 | 284.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 8.58 | -27.32 | 2 | 4 | 1 | 34 | 285.415 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.