| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 22 | Yes |
Popular Name: (2S)-3-methyl-2-[(5-oxo-1-phenyl-4H-1,2,4-triazole-3-carbonyl)amino]butanoic (2S)-3-methyl-2-[(5-oxo-1-phenyl…
| 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) | -1.43 | 5.37 | -48.06 | 2 | 8 | -1 | 120 | 303.298 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.97 | 3.24 | -113.07 | 1 | 8 | -2 | 123 | 302.29 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
