In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 27 | 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) | 4.36 | 7.38 | -11.54 | 2 | 5 | 0 | 59 | 400.832 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 7.86 | -31.37 | 3 | 5 | 1 | 64 | 401.84 | 5 | ↓ |