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402957-11-3

402957-11-3 structure

CAS No:
402957-11-3
Formula:
C31H49N9O6
Chemical Name:
402957-11-3
Synonyms:
402957-11-3;AC1LD8ME;SCHEMBL463964;DTXSID40349288;Cyclopenta[c]pyrrole-1-carboxamide, N-(1H-tetrazol-5-ylacetyl)-L-valyl-3-methyl-L-valyl-N-[1-[(cyclopropylamino)oxoacetyl]butyl]octahydro-, (1S,3aR,6aS)- (9CI)

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402957-11-3 Basic Attributes

Molecular Weight：

643.8 g/mol

Exact Mass：

643.38058032 g/mol

DSSTox ID：

DTXSID40349288

Characteristics

PSA：

208 Å²

Computed Properties

Molecular Weight:643.8
XLogP3:2.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:15
Exact Mass:643.38058032
Monoisotopic Mass:643.38058032
Topological Polar Surface Area:208
Heavy Atom Count:46
Complexity:1170
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 402957-11-3

Basic Attributes
Characteristics
Computed Properties

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