In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 29 | No |
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) | 3.33 | 4.45 | -51.96 | 3 | 5 | -1 | 101 | 407.571 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 2.47 | -10 | 4 | 5 | 0 | 98 | 408.579 | 4 | ↓ |