In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 34 | 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) | 1.26 | 10.1 | -23.24 | 2 | 9 | 0 | 127 | 479.562 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 8.31 | -62.73 | 1 | 9 | -1 | 130 | 478.554 | 8 | ↓ |