In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2010 | 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) | 5.12 | 10.86 | -11.08 | 1 | 6 | 0 | 69 | 437.927 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.12 | 11.43 | -34.41 | 2 | 6 | 1 | 71 | 438.935 | 7 | ↓ |