In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 19 | 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) | 2.18 | 8.68 | -6.55 | 0 | 3 | 0 | 33 | 254.333 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 9.15 | -34.2 | 1 | 3 | 1 | 34 | 255.341 | 4 | ↓ |