In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 26 | 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) | 1.65 | 4.41 | -122.91 | 2 | 6 | -2 | 121 | 362.422 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 2.74 | -58.21 | 3 | 6 | -1 | 118 | 363.43 | 2 | ↓ |