In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 27 | Yes |
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) | 3.41 | 9.16 | -56.88 | 1 | 6 | 1 | 60 | 425.987 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 6.67 | -16.43 | 0 | 6 | 0 | 59 | 424.979 | 6 | ↓ |