In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2005 | 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) | 1.39 | 8.96 | -97.25 | 2 | 3 | 2 | 22 | 247.386 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 9.21 | -185.91 | 3 | 3 | 3 | 23 | 248.394 | 3 | ↓ |