In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 21 | 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) | 2.49 | 7.85 | -40.18 | 1 | 4 | 1 | 34 | 354.268 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 5.61 | -8.3 | 0 | 4 | 0 | 33 | 353.26 | 2 | ↓ |