In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 27 | Yes |
None
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) | 2.39 | 4.92 | -14.8 | 2 | 7 | 0 | 88 | 365.389 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 5.69 | -54.98 | 1 | 7 | -1 | 91 | 364.381 | 4 | ↓ |