In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 32 | Yes |
Popular Name: 8-(azepan-1-ium-1-ylmethyl)-3-(4-chlorophenoxy)-7-hydroxy-2-(trifluoromethyl)chromone 8-(azepan-1-ium-1-ylmethyl)-3-(4…
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) | 6.42 | 2.51 | -46.81 | 2 | 5 | 1 | 64 | 468.879 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.