In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 31 | 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) | 4.32 | 14.16 | -17 | 1 | 6 | 0 | 67 | 424.451 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.32 | 14.54 | -45.29 | 2 | 6 | 1 | 68 | 425.459 | 4 | ↓ |