In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 14 | Yes |
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) | -0.47 | 2.04 | -97.02 | 5 | 4 | 2 | 65 | 201.314 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.47 | 1.69 | -44.99 | 4 | 4 | 1 | 63 | 200.306 | 3 | ↓ |