In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 32 | No |
None
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) | 3.88 | 7.51 | -11.07 | 0 | 7 | 0 | 70 | 437.492 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.88 | 10.46 | -51.32 | 1 | 7 | 1 | 72 | 438.5 | 5 | ↓ |