In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2008 | 31 | 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) | 4.00 | 14.95 | -42.94 | 1 | 6 | 1 | 55 | 459.039 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 12.45 | -11.95 | 0 | 6 | 0 | 54 | 458.031 | 8 | ↓ |