In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 25 | 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) | 1.65 | -3.23 | -14.75 | 2 | 8 | 0 | 102 | 352.435 | 10 | ↓ |
Mid Mid (pH 6-8) | -2.84 | -2.95 | -52.29 | 3 | 8 | 1 | 104 | 353.443 | 10 | ↓ |