In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 34 | 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) | 4.05 | 11.77 | -52.91 | 3 | 6 | 1 | 76 | 485.58 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.05 | 9.6 | -17.4 | 2 | 6 | 0 | 74 | 484.572 | 7 | ↓ |