In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 9th, 2006 | 27 | 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) | 2.23 | 7.34 | -68.11 | 0 | 6 | -1 | 83 | 366.393 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.23 | 6.58 | -17.57 | 1 | 6 | 0 | 80 | 367.401 | 5 | ↓ |