In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 43 | 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) | 7.57 | 14.18 | -45.22 | 0 | 10 | -1 | 150 | 606.721 | 12 | ↓ |
Mid Mid (pH 6-8) | 7.57 | 14.7 | -36.85 | 1 | 10 | 0 | 152 | 607.729 | 12 | ↓ |