In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (1S,6S)-6-[(4-hydroxy-4-oxo-butyl)carbamoyl]cyclohex-3-ene-1-carboxylic (1S,6S)-6-[(4-hydroxy-4-oxo-buty…
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) | 0.11 | 6.56 | -108.09 | 1 | 6 | -2 | 109 | 253.254 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.11 | 4.6 | -50.21 | 2 | 6 | -1 | 107 | 254.262 | 6 | ↓ |