In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2010 | 17 | Yes |
Popular Name: 3-hydroxy-N-[(2-methylthiazol-4-yl)methyl]pyridine-2-carboxamide 3-hydroxy-N-[(2-methylthiazol-4-…
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) | 0.36 | 1.21 | -12.52 | 2 | 5 | 0 | 75 | 249.295 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.36 | 2.69 | -39.97 | 2 | 5 | 0 | 79 | 249.295 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 2.22 | -53.99 | 1 | 5 | -1 | 78 | 248.287 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.36 | 1.68 | -40.65 | 3 | 5 | 1 | 76 | 250.303 | 3 | ↓ |