In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 33 | 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) | 0.90 | 3.9 | -15.35 | 3 | 15 | 0 | 195 | 456.423 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 6.27 | -45.13 | 4 | 15 | 1 | 197 | 457.431 | 7 | ↓ |