In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 33 | 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) | 1.77 | 9.9 | -19.28 | 0 | 8 | 0 | 72 | 447.518 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 12.11 | -60.15 | 1 | 8 | 1 | 73 | 448.526 | 5 | ↓ |