In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 34 | 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) | 1.64 | 8.09 | -20.63 | 0 | 8 | 0 | 67 | 467.614 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 10.35 | -49.69 | 1 | 8 | 1 | 69 | 468.622 | 5 | ↓ |