In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 8th, 2011 | 25 | No |
Popular Name: 5-isopropyl-N-[[6-[(2R)-2-methylmorpholin-4-yl]-3-pyridyl]methyl]-4H-pyrazole-3-carboxamide 5-isopropyl-N-[[6-[(2R)-2-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) | 1.34 | 5.8 | -37.37 | 2 | 7 | 1 | 80 | 344.439 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 5.47 | -11.23 | 1 | 7 | 0 | 79 | 343.431 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.