In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 27 | No |
Popular Name: 1-[(2-chloro-4-nitro-phenoxy)methyl]-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-3-carboxamide 1-[(2-chloro-4-nitro-phenoxy)met…
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) | 2.47 | -0.76 | -49.35 | 2 | 9 | 1 | 106 | 394.839 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.