In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 16 | Yes |
Popular Name: 5-(2-methyl-5-propyl-1,2,4-triazol-3-yl)pyridin-3-amine 5-(2-methyl-5-propyl-1,2,4-triaz…
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) | 1.30 | 3.59 | -10.38 | 2 | 5 | 0 | 70 | 217.276 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.30 | 4.05 | -38.51 | 3 | 5 | 1 | 71 | 218.284 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.