In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 16 | 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) | 2.00 | 5.93 | -29.13 | 4 | 3 | 1 | 55 | 220.34 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 6.94 | -3.71 | 3 | 3 | 0 | 53 | 219.332 | 5 | ↓ |