In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 36 | Yes |
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) | 5.98 | 13.29 | -15.07 | 0 | 6 | 0 | 73 | 503.913 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.98 | 16.15 | -55.67 | 1 | 6 | 1 | 74 | 504.921 | 4 | ↓ |