In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 13 | 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) | -0.53 | -2.29 | -59.53 | 5 | 4 | 1 | 77 | 184.215 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.53 | -2.88 | -9.74 | 4 | 4 | 0 | 76 | 183.207 | 3 | ↓ |