In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 2nd, 2009 | 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) | 0.94 | 2.93 | -29.75 | 4 | 10 | 0 | 123 | 494.596 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 5.18 | -57.72 | 5 | 10 | 1 | 124 | 495.604 | 8 | ↓ |