In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 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) | -0.07 | 0.57 | -34.91 | 4 | 4 | 1 | 68 | 193.274 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.98 | 3.2 | -29.76 | 5 | 4 | 1 | 69 | 193.274 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.07 | 1.29 | -78 | 5 | 4 | 2 | 69 | 194.282 | 5 | ↓ |