In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2009 | 38 | 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) | 5.22 | 14.33 | -75.19 | 1 | 7 | 0 | 83 | 512.606 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.22 | 11.8 | -58.12 | 0 | 7 | -1 | 82 | 511.598 | 11 | ↓ |