In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 21st, 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) | 4.76 | 8.95 | -51.92 | 4 | 6 | 1 | 94 | 486.702 | 10 | ↓ |
Hi High (pH 8-9.5) | 4.76 | 8.54 | -14.78 | 3 | 6 | 0 | 93 | 485.694 | 10 | ↓ |