In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 34 | 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) | 5.20 | 11.27 | -35.95 | 6 | 8 | 1 | 127 | 480.976 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.20 | 11.25 | -15.7 | 5 | 8 | 0 | 126 | 479.968 | 6 | ↓ |