In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 35 | 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) | 2.99 | 16.16 | -20.8 | 1 | 8 | 0 | 85 | 482.466 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 16.64 | -43.17 | 2 | 8 | 1 | 86 | 483.474 | 8 | ↓ |