In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 26 | 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) | 2.03 | 6.66 | -10.85 | 0 | 5 | 0 | 42 | 352.434 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 8.95 | -46.08 | 1 | 5 | 1 | 43 | 353.442 | 5 | ↓ |