In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 14 | Yes |
Popular Name: (2R)-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]propanoic (2R)-2-[[2-(1,2,4-triazol-1-yl)a…
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) | -3.31 | 3.1 | -52.78 | 1 | 7 | -1 | 100 | 197.174 | 4 | ↓ |
Popular Name: 2-[isopropyl-[2-(1,2,4-triazol-1-yl)acetyl]amino]acetic 2-[isopropyl-[2-(1,2,4-triazol-1…
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) | -2.18 | 6.75 | -57.86 | 0 | 7 | -1 | 91 | 225.228 | 5 | ↓ |