In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | 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) | 0.08 | 1.74 | -48.12 | 4 | 6 | 1 | 82 | 265.337 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.08 | 1.41 | -9.81 | 3 | 6 | 0 | 80 | 264.329 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 2.09 | -93.03 | 5 | 6 | 2 | 83 | 266.345 | 4 | ↓ |