In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2010 | 21 | No |
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) | 6.92 | 10.26 | -37.21 | 3 | 2 | 1 | 37 | 292.487 | 13 | ↓ |
Hi High (pH 8-9.5) | 6.92 | 11.01 | -32.86 | 2 | 2 | 0 | 40 | 291.479 | 13 | ↓ |