In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 32 | No |
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) | 2.56 | 2.9 | -14.68 | 3 | 9 | 0 | 125 | 434.452 | 6 | ↓ |
Ref Reference (pH 7) | 2.56 | 3.52 | -16.17 | 3 | 9 | 0 | 125 | 434.452 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 3.82 | -68.04 | 4 | 9 | 1 | 126 | 435.46 | 6 | ↓ |