In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2008 | 20 | Yes |
Popular Name: 3-methyl-4-oxo-N-(2-pyridyl)-1,5,6,7-tetrahydroindole-2-carboxamide 3-methyl-4-oxo-N-(2-pyridyl)-1,5…
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) | 1.73 | 6.19 | -22.19 | 2 | 5 | 0 | 75 | 269.304 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.73 | 5.97 | -39.48 | 3 | 5 | 1 | 76 | 270.312 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.