In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 21 | 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) | 4.99 | 9.46 | -55.01 | 1 | 3 | -1 | 52 | 282.363 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.99 | 8.34 | -9.09 | 2 | 3 | 0 | 49 | 283.371 | 5 | ↓ |