In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 34 | 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) | 3.88 | 9.82 | -53.42 | 0 | 10 | -1 | 142 | 476.446 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.33 | 9.92 | -22.17 | 1 | 10 | 0 | 139 | 477.454 | 5 | ↓ |