In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 16 | Yes |
Popular Name: (2S)-4-amino-2-[(4-hydroxy-4-oxo-butanoyl)amino]-4-oxo-butanoic (2S)-4-amino-2-[(4-hydroxy-4-oxo…
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) | -2.79 | 0.05 | -109.82 | 3 | 8 | -2 | 152 | 230.176 | 7 | ↓ |
Lo Low (pH 4.5-6) | -2.79 | -1.93 | -55.13 | 4 | 8 | -1 | 150 | 231.184 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.