In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 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) | 3.70 | 10.61 | -51.89 | 3 | 6 | 1 | 72 | 446.571 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 8.67 | -12.25 | 2 | 6 | 0 | 71 | 445.563 | 10 | ↓ |