In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 39 | 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) | 3.13 | 11.65 | -97.78 | 4 | 8 | 2 | 97 | 533.648 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 11.28 | -55.23 | 3 | 8 | 1 | 95 | 532.64 | 5 | ↓ |