In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 24 | Yes |
None
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) | 3.00 | 8.71 | -13.29 | 1 | 7 | 0 | 82 | 336.436 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 9.19 | -50.3 | 2 | 7 | 1 | 83 | 337.444 | 10 | ↓ |