In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2009 | 18 | 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) | 2.96 | 4.69 | -49.04 | 0 | 4 | -1 | 61 | 281.382 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.96 | 4.58 | -12.13 | 1 | 4 | 0 | 59 | 282.39 | 3 | ↓ |