In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 12 | Yes |
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) | -1.26 | -0.75 | -47.33 | 3 | 4 | 1 | 51 | 172.252 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.26 | -1.15 | -8.47 | 2 | 4 | 0 | 50 | 171.244 | 2 | ↓ |