In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 37 | 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) | 2.26 | 7.29 | -50.19 | 6 | 8 | 1 | 126 | 501.607 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 7.1 | -16.91 | 5 | 8 | 0 | 125 | 500.599 | 7 | ↓ |