In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 31 | 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) | 2.99 | 9.48 | -13.08 | 1 | 9 | 0 | 103 | 417.473 | 5 | ↓ |
Ref Reference (pH 7) | 2.81 | 12.13 | -12.38 | 1 | 9 | 0 | 99 | 417.473 | 5 | ↓ |