| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 11th, 2009 | 16 | No |
Popular Name: 2-(2,3-Dichlorophenyl)-2-guanidinyliminoacetonitrile 2-(2,3-Dichlorophenyl)-2-guanidi…
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CAS Numbers: 84689-20-3 , [84689-20-3]
| 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) | 1.73 | 5.27 | -38.93 | 5 | 5 | 1 | 100 | 257.104 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 5.3 | -10.11 | 4 | 5 | 0 | 98 | 256.096 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.60 | 5.25 | -11.92 | 4 | 5 | 0 | 101 | 256.096 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.