In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 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) | 2.17 | 6.62 | -63.53 | 2 | 8 | 1 | 91 | 492.021 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 4.15 | -26.96 | 1 | 8 | 0 | 90 | 491.013 | 6 | ↓ |