In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 14 | 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) | 1.08 | 2.56 | -34.03 | 4 | 3 | 1 | 60 | 193.27 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 1.61 | -6.44 | 3 | 3 | 0 | 55 | 192.262 | 4 | ↓ |