In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 37 | 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) | 3.89 | 7.27 | -14.73 | 2 | 7 | 0 | 82 | 518.683 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 9.54 | -53.35 | 3 | 7 | 1 | 83 | 519.691 | 9 | ↓ |