In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 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) | 2.02 | 7.03 | -12.25 | 0 | 5 | 0 | 42 | 352.434 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 9.17 | -49.18 | 1 | 5 | 1 | 43 | 353.442 | 3 | ↓ |