In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 25 | 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) | 4.03 | 6.7 | -11.08 | 2 | 5 | 0 | 69 | 374.227 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 7.47 | -49.49 | 1 | 5 | -1 | 72 | 373.219 | 2 | ↓ |