In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 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) | 4.34 | 13.88 | -48.27 | 1 | 5 | 1 | 45 | 480.679 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.34 | 12.17 | -13.4 | 0 | 5 | 0 | 44 | 479.671 | 4 | ↓ |