In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 21 | No |
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) | -1.00 | 5.27 | -38.56 | 3 | 7 | 0 | 106 | 301.387 | 9 | ↓ |
Hi High (pH 8-9.5) | -1.00 | 4.09 | -61.91 | 2 | 7 | -1 | 102 | 300.379 | 9 | ↓ |