| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 21 | Yes |
Popular Name: BRN 3418497; Guanidine, 4,4'-methylenediphenyldi-; LS-73786; p,p'-Diguanidinodiphenylmethane BRN 3418497; Guanidine, 4,4'-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) | 1.77 | -5.22 | -71.17 | 10 | 6 | 2 | 127 | 284.367 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425-7-O | Plasmodium Falciparum (cluster #7 Of 22), Other | Other | 32 | 0.50 | Functional ≤ 10μM |
| Z50725-1-O | Trypanosoma Brucei Rhodesiense (cluster #1 Of 7), Other | Other | 161 | 0.45 | Functional ≤ 10μM |
| Z81135-4-O | L6 (Skeletal Muscle Myoblast Cells) (cluster #4 Of 6), Other | Other | 2800 | 0.37 | ADME/T ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50425 | Z50425 | Plasmodium Falciparum | 32 | 0.50 | Functional ≤ 10μM |
| Z50725 | Z50725 | Trypanosoma Brucei Rhodesiense | 161 | 0.45 | Functional ≤ 10μM |
| Z81135 | Z81135 | L6 (Skeletal Muscle Myoblast Cells) | 2800 | 0.37 | ADME/T ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.