In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 21 | Yes |
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) | 3.49 | 9.59 | -51.53 | 0 | 4 | -1 | 59 | 291.367 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.49 | 7.74 | -8.86 | 1 | 4 | 0 | 56 | 292.375 | 7 | ↓ |