In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 15 | 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) | -0.81 | 1.45 | -65.78 | 3 | 4 | 1 | 77 | 202.237 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.81 | 1.12 | -14.97 | 2 | 4 | 0 | 76 | 201.229 | 3 | ↓ |