In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 22 | Yes |
None
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) | 1.44 | -3.82 | -11.37 | 4 | 7 | 0 | 99 | 303.366 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.44 | -3.62 | -38.89 | 5 | 7 | 1 | 100 | 304.374 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.44 | -3.63 | -39.25 | 5 | 7 | 1 | 100 | 304.374 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.