In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 31 | 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) | 3.30 | 8.08 | -13.46 | 2 | 6 | 0 | 82 | 435.549 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.30 | 10.29 | -52.05 | 3 | 6 | 1 | 84 | 436.557 | 7 | ↓ |