In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2006 | 15 | 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) | 0.96 | 5.14 | -9.54 | 0 | 3 | 0 | 33 | 204.273 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.96 | 5.64 | -28.12 | 1 | 3 | 1 | 34 | 205.281 | 1 | ↓ |