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Cemadotin

Cemadotin structure

CAS No:
159776-69-9
Formula:
C35H56N6O5
Chemical Name:
Cemadotin
Synonyms:
cemadotin;LU 103793;LU-103793;LU103793;N,N-dimethyl-L-valyl-L-valyl-N-methyl-L-valyl-L-prolyl-L-prolinebenzylamide;NSC 669356D;NSC D-669356;NSC D669356;NSC-669356D;NSC-D669356

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Cemadotin Basic Attributes

Molecular Weight：

640.864

Exact Mass：

640.43100

DSSTox ID：

DTXSID70166723

Characteristics

PSA：

122

XLogP3：

3.15240

Density：

1.138±0.06 g/cm3(Predicted)

Boiling Point：

857.7±65.0 °C(Predicted)

Flash Point：

472.5ºC

Refractive Index：

1.545

Drug Information

MeSH Entry Terms：

cemadotin

Computed Properties

Molecular Weight:640.9
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:13
Exact Mass:640.43121891
Monoisotopic Mass:640.43121891
Topological Polar Surface Area:122
Heavy Atom Count:46
Complexity:1070
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Cemadotin

Basic Attributes
Characteristics
Drug Information
Computed Properties

Cemadotin

SDS

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