In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 18 | Yes |
Popular Name: 3-[(dimethylamino)methyl]-4-(2-methoxyphenyl)-1H-pyrazol-5-amine 3-[(dimethylamino)methyl]-4-(2-m…
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) | 1.70 | 5 | -95.87 | 5 | 5 | 2 | 70 | 248.33 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 2.35 | -9.65 | 3 | 5 | 0 | 67 | 246.314 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 4.88 | -32.96 | 4 | 5 | 1 | 68 | 247.322 | 4 | ↓ |