| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2006 | 23 | No |
Popular Name: Oryzalin Oryzalin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 19044-88-3 , [19044-88-3]
| 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) | 2.27 | 5.39 | -10.97 | 2 | 10 | 0 | 155 | 346.365 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| UniProt Database Links | AB1B_ARATH; EB1C_ARATH; MA655_ARATH; MPK4_ARATH; TBA1_ELEIN | ChEBI |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z102116-1-O | Toxoplasma Gondii RH (cluster #1 Of 2), Other | Other | 5500 | 0.32 | Functional ≤ 10μM |
| Z50424-1-O | Cryptosporidium Parvum (cluster #1 Of 2), Other | Other | 800 | 0.37 | Functional ≤ 10μM |
| Z50472-1-O | Toxoplasma Gondii (cluster #1 Of 4), Other | Other | 250 | 0.40 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50424 | Z50424 | Cryptosporidium Parvum | 700 | 0.37 | Functional ≤ 10μM |
| Z50472 | Z50472 | Toxoplasma Gondii | 250 | 0.40 | Functional ≤ 10μM |
| Z102116 | Z102116 | Toxoplasma Gondii RH | 1260 | 0.36 | Functional ≤ 10μM |
