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NCIStruc1_000718

NCIStruc1_000718 structure

CAS No:
6266-83-7
Formula:
C40H44N8O8S2
Chemical Name:
NCIStruc1_000718
Synonyms:
NSC36806;NSC-36806;6266-83-7;NCIStruc1_000718;NCIStruc2_000267;CHEMBL1371838;DTXSID70284330;NCI36806;CCG-38226;NCGC00013425;ZINC95544209;NCGC00013425-02;NCGC00096540-01;NCI60_003385;2,21-dithia-7,10,13,16,26,29,32,35-octaazaheptacyclo[34.2.2.2~3,6~.2~10,13~.2~17,20~.2~22,25~.2~29,32~]pentaconta-1(38),3,5,17,19,22,24,36,39,43,45,49-dodecaene-8,15,27,34-tetrone 2,2,21,21-tetraoxide

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NCIStruc1_000718 Basic Attributes

Molecular Weight：

829.0 g/mol

Exact Mass：

828.27235274 g/mol

NSC Number：

36806

DSSTox ID：

DTXSID70284330

Characteristics

PSA：

214 Å²

Computed Properties

Molecular Weight:829.0
XLogP3:1.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Exact Mass:828.27235274
Monoisotopic Mass:828.27235274
Topological Polar Surface Area:214
Heavy Atom Count:58
Complexity:1410
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of NCIStruc1_000718

Basic Attributes
Characteristics
Computed Properties

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