In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 47 | No |
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) | 7.21 | 19.8 | -282.68 | 10 | 7 | 5 | 101 | 659.081 | 34 | ↓ |
Hi High (pH 8-9.5) | 7.21 | 18.42 | -216.33 | 9 | 7 | 4 | 97 | 658.073 | 34 | ↓ |