In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | 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) | 1.32 | 5.99 | -80.8 | 3 | 5 | 1 | 71 | 238.311 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 3.82 | -33.09 | 2 | 5 | 0 | 70 | 237.303 | 7 | ↓ |