In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2008 | 28 | 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) | 4.11 | 8.82 | -11.94 | 2 | 6 | 0 | 83 | 382.508 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.11 | 9.21 | -33.54 | 3 | 6 | 1 | 85 | 383.516 | 8 | ↓ |