In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 32 | 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) | 3.48 | 5.95 | -24.98 | 4 | 8 | 0 | 122 | 434.496 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 6.71 | -63.35 | 3 | 8 | -1 | 124 | 433.488 | 9 | ↓ |