In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 17 | Yes |
Popular Name: 6-[[(1S)-1-methyl-2-pyrazol-1-yl-ethyl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(1S)-1-methyl-2-pyrazol-1-yl…
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) | -0.83 | 0.2 | -10.86 | 3 | 8 | 0 | 108 | 236.235 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.37 | -1.46 | -45.03 | 2 | 8 | -1 | 112 | 235.227 | 4 | ↓ |