In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 24 | 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) | 5.41 | 12.75 | -42.42 | 1 | 2 | 1 | 14 | 324.488 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.41 | 10.2 | -4.01 | 0 | 2 | 0 | 12 | 323.48 | 7 | ↓ |