| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 16 | Yes |
Popular Name: 3-methyl-N2-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridine-2,5-diamine 3-methyl-N2-[(4-methyl-1,2,4-tri…
| 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) | -0.05 | 4.54 | -36.59 | 4 | 6 | 1 | 83 | 219.272 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 4.18 | -12.07 | 3 | 6 | 0 | 82 | 218.264 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
