In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 30 | 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) | 5.30 | 12.59 | -7.62 | 0 | 4 | 0 | 32 | 424.589 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.30 | 14.82 | -51.56 | 1 | 4 | 1 | 33 | 425.597 | 4 | ↓ |