In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2008 | 29 | No |
None
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) | 0.56 | 3.71 | -97.18 | 0 | 10 | -2 | 147 | 398.327 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.10 | 6.38 | -56.3 | 1 | 10 | -1 | 144 | 399.335 | 7 | ↓ |