In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 34 | 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) | 4.24 | 4.32 | -14.15 | 2 | 9 | 0 | 100 | 468.554 | 10 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | 5.43 | -27.57 | 3 | 9 | 1 | 101 | 469.562 | 10 | ↓ |