In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 34 | 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) | 7.13 | 16.71 | -38.59 | 2 | 3 | 1 | 29 | 445.586 | 5 | ↓ |
Mid Mid (pH 6-8) | 7.13 | 15.5 | -6.75 | 1 | 3 | 0 | 28 | 444.578 | 5 | ↓ |