In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | 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) | -0.63 | 0.65 | -42.07 | 3 | 5 | 1 | 66 | 219.305 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.63 | 0.24 | -6.26 | 2 | 5 | 0 | 65 | 218.297 | 8 | ↓ |