In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 38 | 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) | 5.62 | 14.91 | -47.84 | 2 | 6 | 1 | 71 | 513.658 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.04 | 1.81 | -57.46 | 1 | 6 | 1 | 68 | 513.658 | 11 | ↓ |