In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 39 | 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) | 4.29 | 13.21 | -16.89 | 0 | 7 | 0 | 66 | 533.713 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.29 | 15.5 | -65.57 | 1 | 7 | 1 | 67 | 534.721 | 11 | ↓ |