In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 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) | 4.28 | 13.08 | -20.04 | 1 | 10 | 0 | 128 | 496.574 | 10 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 11.85 | -39.69 | 0 | 10 | -1 | 134 | 495.566 | 10 | ↓ |