In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 20 | Yes |
Popular Name: (2S)-4-[[1-(1-ethylpropyl)pyrazol-3-yl]methyl]morpholine-2-carboxylic (2S)-4-[[1-(1-ethylpropyl)pyrazo…
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) | 1.25 | 5.64 | -51.04 | 0 | 6 | -1 | 70 | 280.348 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.25 | 7.67 | -46.89 | 1 | 6 | 0 | 72 | 281.356 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.