In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | 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) | 2.41 | 10.04 | -55.67 | 0 | 5 | -1 | 82 | 262.248 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.41 | 10.52 | -64.52 | 1 | 5 | 0 | 83 | 263.256 | 2 | ↓ |