In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2005 | 16 | 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) | 1.69 | 7.87 | -15.84 | 0 | 5 | 0 | 64 | 217.228 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 8.28 | -39.04 | 1 | 5 | 1 | 65 | 218.236 | 2 | ↓ |