In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 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) | 4.36 | 9.78 | -11.61 | 0 | 3 | 0 | 27 | 280.371 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.36 | 10.28 | -24.28 | 1 | 3 | 1 | 28 | 281.379 | 4 | ↓ |