In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2008 | 29 | 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) | 3.64 | 10.08 | -19.81 | 1 | 6 | 0 | 73 | 405.889 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.64 | 10.51 | -28.29 | 2 | 6 | 1 | 74 | 406.897 | 2 | ↓ |