In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 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) | 0.08 | 5.54 | -41.31 | 2 | 5 | 0 | 77 | 216.281 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 4.64 | -55.05 | 1 | 5 | -1 | 72 | 215.273 | 7 | ↓ |