In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 34 | 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) | 5.47 | 14.3 | -9.01 | 0 | 5 | 0 | 46 | 518.148 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.47 | 16.57 | -42.43 | 1 | 5 | 1 | 47 | 519.156 | 10 | ↓ |