In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 16 | 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) | 4.07 | 7.5 | -8.04 | 1 | 2 | 0 | 29 | 219.328 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.25 | 6.58 | -25.05 | 2 | 2 | 1 | 34 | 220.336 | 4 | ↓ |