In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | 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) | 2.00 | 7.49 | -95.28 | 5 | 4 | 2 | 81 | 270.38 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 7.08 | -49.84 | 4 | 4 | 1 | 80 | 269.372 | 7 | ↓ |