| BioID | bio199045 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL33979 |
|---|
| Molecular Formula | C12H13ClN2O5 |
|---|
| Molecular Weight | 300.7 |
|---|
| Molecular Weight (Monoisotopic) | 300.0513 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
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| Synonyms | 2-[({[(2-Chloroethyl)(Nitroso)Amino]Carbonyl}Oxy)Methyl]Phenyl Acetate |
|---|
| Smiles | CC(=O)Oc1ccccc1COC(=O)N(CCCl)N=O |
|---|
| Inchi | InChI=1S/C12H13ClN2O5/c1-9(16)20-11-5-3-2-4-10(11)8-19-12(17)15(14-18)7-6-13/h2-5H,6-8H2,1H3 |
|---|
| Inchi Key | VPNZFCIDCZJXSN-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | -0.1 |
|---|
| Records Key | ['18'] |
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| Records Name | ['2-[({[(2-chloroethyl)(nitroso)amino]carbonyl}oxy)methyl]phenyl acetate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
