In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2009 | 36 | 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) | 4.59 | 10.11 | -33.37 | 4 | 12 | 1 | 151 | 496.596 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.59 | 8.13 | -9.87 | 3 | 12 | 0 | 150 | 495.588 | 11 | ↓ |