In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 10th, 2006 | 22 | No |
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) | 1.30 | 2.75 | -78.22 | 0 | 6 | -1 | 87 | 320.325 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.23 | 4.36 | -36.52 | 1 | 6 | 0 | 81 | 321.333 | 2 | ↓ |