In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | 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) | 4.28 | 9.08 | -3.27 | 1 | 1 | 0 | 12 | 259.78 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 10.12 | -38.44 | 2 | 1 | 1 | 17 | 260.788 | 5 | ↓ |