In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 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) | 3.92 | -2.94 | -11.43 | 1 | 6 | 0 | 91 | 347.179 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.92 | -2.36 | -32.62 | 0 | 6 | -1 | 94 | 346.171 | 4 | ↓ |