Chemical ID: 3965499

C(CC(C(=O)O)N)CNC(=N)N
Chemical ID:
3965499
Name [?]:
2-amino-5-guanidino-pentanoic acid
SMILES [?]:
C(CC(C(=O)O)N)CNC(=N)N
InChi [?]:
InChI=1/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)
InChi Info:
AuxInfo=1/1/N:1,2,8,3,4,10,7,11,12,9,5,6/E:(8,9)(11,12)/rA:12cCCCCOONCNCNN/rB:s1;s2;s3;d4;s4;s3;s1;s8;s9;w10;s10;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H14N4O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.41201
Area:368.186
Solvation:-2.79263
Coulombic:-77.634
Bond Count [?]
All:11
Single:9
Double:2
Rotors:6
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:174.201
H-Bond Donors:7
H-Bond Acceptors:6
XLogP:-2.92
LogP (Chemaxon):-4.43

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