In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 28 | Yes |
None
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) | 1.86 | 8.08 | -51.77 | 2 | 7 | 1 | 71 | 397.528 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 6.78 | -9.26 | 1 | 7 | 0 | 66 | 396.52 | 2 | ↓ |