In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 21 | Yes |
Popular Name: (5R)-1-ethyl-5-(1H-1,2,4-triazol-3-ylmethylamino)-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-1-ethyl-5-(1H-1,2,4-triazol…
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) | -0.04 | 4.77 | -61.95 | 2 | 8 | -1 | 112 | 289.319 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.04 | 5.97 | -76.74 | 3 | 8 | 0 | 116 | 290.327 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.