In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 20th, 2009 | 19 | 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) | 2.35 | 6.13 | -45.29 | 1 | 5 | -1 | 87 | 265.285 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 6.98 | -101.53 | 0 | 5 | -2 | 89 | 264.277 | 7 | ↓ |