In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 18 | Yes |
Popular Name: N-[(4-fluorophenyl)methyl]-3-hydroxy-pyridine-2-carboxamide N-[(4-fluorophenyl)methyl]-3-hyd…
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) | 1.64 | 4.92 | -40.17 | 2 | 4 | 0 | 66 | 246.241 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 3.56 | -6.52 | 2 | 4 | 0 | 62 | 246.241 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 4.43 | -47.89 | 1 | 4 | -1 | 65 | 245.233 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 4 | -41.71 | 3 | 4 | 1 | 63 | 247.249 | 3 | ↓ |