In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 33 | 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) | 6.22 | 11.41 | -43 | 2 | 6 | 1 | 73 | 454.587 | 11 | ↓ |
Mid Mid (pH 6-8) | 6.22 | 11.96 | -30.84 | 1 | 6 | 0 | 76 | 453.579 | 11 | ↓ |