CID 28927865
PubChem CID
28927865
Structure
Molecular Formula
Status
Non-live
Molecular Weight
190.29 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
[(2S)-1-amino-1-oxopropan-2-yl]-(3-amino-3-sulfanylidenepropyl)-methylazanium
InChI=1S/C7H15N3OS/c1-5(7(9)11)10(2)4-3-6(8)12/h5H,3-4H2,1-2H3,(H2,8,12)(H2,9,11)/p+1/t5-/m0/s1
ZZAAQLZNSMCURR-YFKPBYRVSA-O
C[C@@H](C(=O)N)[NH+](C)CCC(=S)N
C7H16N3OS+
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
190.29 g/mol
Property Name
XLogP3-AA
Property Value
-0.9
Property Name
Hydrogen Bond Donor Count
Property Value
3
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
5
Property Name
Exact Mass
Property Value
190.10140832 g/mol
Property Name
Monoisotopic Mass
Property Value
190.10140832 g/mol
Property Name
Topological Polar Surface Area
Property Value
106 A^2
Property Name
Heavy Atom Count
Property Value
12
Property Name
Formal Charge
Property Value
1
Property Name
Complexity
Property Value
183
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS