In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2009 | 19 | 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) | 1.17 | 3.78 | -60.27 | 3 | 5 | 1 | 62 | 260.317 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.17 | 2.4 | -12.73 | 2 | 5 | 0 | 57 | 259.309 | 2 | ↓ |