In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 22 | 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) | 0.54 | 0.84 | -9.54 | 1 | 7 | 0 | 79 | 330.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 3.04 | -42.12 | 2 | 7 | 1 | 80 | 331.462 | 5 | ↓ |