In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 26 | 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) | 2.33 | 8.14 | -38.23 | 1 | 6 | -1 | 79 | 394.473 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 9.24 | -16.45 | 2 | 6 | 0 | 72 | 395.481 | 7 | ↓ |