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| Ligand Name: 2-(isothiocyanatomethyl)furan |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB172 |
PubChem:
78380
|
Synonym(s):
- furfuryl isothiocyanate
- 2-furfuryl isothiocyanate
- 4650-60-6
- 2-furylmethyl isothiocyanate
- 2-isothiocyanatomethyl-furan
- furan, 2-(isothiocyanatomethyl)-
- 2-furanylmethyl isothiocyanate
- mfcd00014112
- 2-furylmethanisothiocyanate
- furfurylisothiocyanate
- furylmethylisothiocyanate
- 7-bromo-quinolin-2-ylamine
- schembl835383
- 2-(isothiocyanatomethyl)furan #
- dtxsid90963599
- hms1782b20
- albb-013134
- zinc2146625
- einecs 225-079-0
- 4029ae
- bbl009998
- sbb017397
- stk397324
- 2-furfuryl isothiocyanate, aldrichcpr
- akos000212137
- mcule-6224898724
- ps-10315
- st078380
- db-051382
- ft-0626574
- r1277
- a11814
- 2-furfuryl isothiocyanate 33% (w/v) in chloroform
- f1915-0017
show 33 synonym(s)
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: S=C=NCc1ccco1 |
| Standard InChI: InChI=1S/C6H5NOS/c9-5-7-4-6-2-1-3-8-6/h1-3H,4H2 |
| Molecular Formula: C6H5NOS |
Mol. Weight: 139.00919 |
logP: 1.8824 |
| HBD: 0 | HBA: 3 |
| #Rotatable Bonds: 2 | TPSA: 25.5 |