In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 26 | No |
None
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) | 3.96 | 7.72 | -8.51 | 0 | 4 | 0 | 43 | 371.795 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.96 | 10.68 | -41.71 | 1 | 4 | 1 | 44 | 372.803 | 2 | ↓ |