In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2007 | 33 | 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) | 5.26 | 12.48 | -52.95 | 2 | 6 | 1 | 75 | 453.603 | 13 | ↓ |
Mid Mid (pH 6-8) | 4.68 | 13.14 | -63.47 | 1 | 6 | 1 | 72 | 453.603 | 13 | ↓ |