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S-Nitrosocaptopril

S-Nitrosocaptopril structure

CAS No:
122130-63-6
Formula:
C9H14N2O4S
Chemical Name:
S-Nitrosocaptopril
Synonyms:
L-Proline,1-[(2S)-2-methyl-3-(nitrosothio)-1-oxopropyl]-;L-Proline,1-[2-methyl-3-(nitrosothio)-1-oxopropyl]-,(S)-;1-[(2S)-2-Methyl-3-(nitrosothio)-1-oxopropyl]-L-proline;S-Nitrosocaptopril

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S-Nitrosocaptopril Basic Attributes

Molecular Weight：

246.28300

Exact Mass：

246.28

DSSTox ID：

DTXSID20153527

Characteristics

PSA：

112.34000

XLogP3：

1.05060

Density：

1.47g/cm3

Boiling Point：

479ºC

Flash Point：

238.6ºC

Refractive Index：

1.629

Vapor Pressure：

3.63E-10mmHg at 25°C

Drug Information

MeSH Entry Terms：

S-nitrosocaptopril

Computed Properties

Molecular Weight:246.29
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:246.06742811
Monoisotopic Mass:246.06742811
Topological Polar Surface Area:112
Heavy Atom Count:16
Complexity:297
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of S-Nitrosocaptopril

Basic Attributes
Characteristics
Drug Information
Computed Properties

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