In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 20 | Yes |
Popular Name: 3-hydroxy-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide 3-hydroxy-N-[4-(trifluoromethyl)…
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) | 2.67 | 5.65 | -44.15 | 2 | 4 | 0 | 66 | 282.221 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 4.29 | -7.04 | 2 | 4 | 0 | 62 | 282.221 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.67 | 5.15 | -47.29 | 1 | 4 | -1 | 65 | 281.213 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 4.71 | -46.02 | 3 | 4 | 1 | 63 | 283.229 | 3 | ↓ |