In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 33 | 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) | 3.21 | 10.22 | -51.94 | 2 | 8 | 1 | 73 | 448.547 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 7.95 | -16.49 | 1 | 8 | 0 | 72 | 447.539 | 6 | ↓ |