In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2012 | 20 | Yes |
Popular Name: N-[3-[(1R)-1-(ethylamino)ethyl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide N-[3-[(1R)-1-(ethylamino)ethyl]p…
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) | 1.83 | 4.89 | -45.7 | 4 | 5 | 1 | 74 | 273.36 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 4.91 | -49.58 | 4 | 5 | 1 | 74 | 273.36 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.