Structure
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Relationships |
Total Number of functionally related protein(s) :
6
Total Number of Articles : 5
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PubChem |
422686
|
Molecular Formula |
C17H16N2S |
SMILES |
CC1=C2C=CC=CC2=C(C3=CC=CC=C13)CSC(=N)N |
InChI |
InChI=1S/C17H16N2S/c1-11-12-6-2-4-8-14(12)16(10-20-17(18)19)15-9-5-3-7-13(11)15/h2-9H,10H2,1H3,(H3,18,19) |
synonyms |
- (10-Methyl-9-anthryl)methyl imidothiocarbamate
- E9QK2XW6VT
- UNII-E9QK2XW6VT
- NSC 146109
- NSC146109
- NSC-146109
- NCIStruc1_001785
- NCIStruc2_001799
- CHEMBL1409073
- SCHEMBL10048252
- DTXSID30208178
- CCG-36633
- NCGC00014387
- NCI146109
- NCGC00014387-03
- NCGC00092324-02
- NCI60_000991
- 2-[(10-methyl-9-anthryl)methyl]isothiourea
- Pseudourea, {2-[(10-methyl-9-anthryl)methyl]-2-thio-,} monohydrochloride
- CARBAMIMIDOTHIOIC ACID, (10-METHYL-9-ANTHRACENYL)METHYL ESTER, MONOHYDROCHLORIDE
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Properties |
Property |
Value |
MW |
280.4 g/mol |
HBD |
2 |
HBA |
2 |
Rotatable Bond Count |
3 |
Exact Mass |
280.10341969 g/mol |
Monoisotopic Mass |
280.10341969 g/mol |
Heavy Atom Count |
20 |
Isotope Atom Count |
0 |
Atom Stereo Count |
0 |
Covalent Unit Count |
1 |
Complexity |
333 |
xlogp |
5.1 |
Topological Polar Surface Area |
75.2 |
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