In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2006 | 24 | 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) | 4.05 | 12.1 | -31.96 | 1 | 3 | 1 | 23 | 328.476 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.05 | 9.89 | -5.51 | 0 | 3 | 0 | 22 | 327.468 | 11 | ↓ |