In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 28 | 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) | 3.69 | 10.31 | -14.95 | 1 | 6 | 0 | 67 | 386.54 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.69 | 10.84 | -33.72 | 2 | 6 | 1 | 68 | 387.548 | 9 | ↓ |