In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2008 | 32 | Yes |
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) | 4.28 | 10.13 | -28.19 | 1 | 7 | 0 | 82 | 495.964 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 10.43 | -48.99 | 2 | 7 | 1 | 83 | 496.972 | 8 | ↓ |