In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 18 | 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) | 1.28 | 5.57 | -34.31 | 3 | 4 | 0 | 77 | 245.278 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 6.33 | -50.76 | 2 | 4 | -1 | 80 | 244.27 | 4 | ↓ |