In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 26th, 2011 | 15 | No |
Popular Name: 3-(1,2,4-triazol-1-yl)-N-(4H-1,2,4-triazol-3-yl)propanamide 3-(1,2,4-triazol-1-yl)-N-(4H-1,2…
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) | -1.51 | 5.01 | -42.31 | 1 | 8 | -1 | 108 | 206.189 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.69 | 6.29 | -17.09 | 2 | 8 | 0 | 101 | 207.197 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.