In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 31 | 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) | 2.90 | 8.51 | -16.49 | 1 | 7 | 0 | 93 | 419.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 9.23 | -21.71 | 0 | 7 | 0 | 90 | 419.433 | 5 | ↓ |