In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2004 | 31 | 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) | 2.64 | 6.7 | -19.06 | 1 | 8 | 0 | 96 | 480.589 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 7.61 | -60.34 | 0 | 8 | -1 | 98 | 479.581 | 7 | ↓ |