Chemical ID: 4514231

c12c(non1)NC3C(N2)NC(=O)N3
Chemical ID:
4514231
Name [?]:
None
SMILES [?]:
c12c(non1)NC3C(N2)NC(=O)N3
InChi [?]:
InChI=1/C5H6N6O2/c12-5-8-1-2(9-5)7-4-3(6-1)10-13-11-4/h1-2H,(H,6,10)(H,7,11)(H2,8,9,12)
InChi Info:
AuxInfo=1/1/N:7,8,2,1,11,6,9,13,10,3,5,12,4/E:(1,2)(3,4)(6,7)(8,9)(10,11)/gE:(1,2)/rA:13cCCNONNCCNNCON/rB:s1;d2;s3;d1s4;s2;s6;s7;s1s8;s8;s10;d11;s7s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H6N6O2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:2
ZAP Information [?]
Total:5.23501
Area:312.416
Solvation:-2.57538
Coulombic:-62.0823
Bond Count [?]
All:15
Single:12
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:182.14
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:0.12
LogP (Chemaxon):-0.25

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