In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 26 | 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) | 1.60 | 5.22 | -40.88 | 3 | 6 | 1 | 66 | 367.42 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 5.15 | -42.52 | 3 | 6 | 1 | 66 | 367.42 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.60 | 2.91 | -10.09 | 2 | 6 | 0 | 65 | 366.412 | 6 | ↓ |