In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 33 | 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) | 2.80 | 9.65 | -14.99 | 1 | 10 | 0 | 112 | 447.499 | 6 | ↓ |
Ref Reference (pH 7) | 2.62 | 12.3 | -14.3 | 1 | 10 | 0 | 108 | 447.499 | 6 | ↓ |