In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2009 | 29 | No |
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 | -6.37 | -109.64 | 14 | 14 | 1 | 278 | 417.447 | 14 | ↓ |
Hi High (pH 8-9.5) | -5.12 | -6.76 | -75.97 | 13 | 14 | 0 | 277 | 416.439 | 14 | ↓ |