Chemical ID: 5185154

Cc1cc2cc3cccnn3c2nn1
Chemical ID:
5185154
Name [?]:
None
SMILES [?]:
Cc1cc2cc3cccnn3c2nn1
InChi [?]:
InChI=1/C10H8N4/c1-7-5-8-6-9-3-2-4-11-14(9)10(8)13-12-7/h2-6H,1H3
InChi Info:
AuxInfo=1/0/N:1,8,7,9,3,5,2,4,6,12,10,14,13,11/rA:14nCCCCCCCCCNNCNN/rB:s1;s2;d3;s4;d5;s6;d7;s8;d9;s6s10;s4s11;d12;d2s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8N4
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.67641
Area:338.417
Solvation:-2.78402
Coulombic:-7.37
Bond Count [?]
All:16
Single:10
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:184.197
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.33
LogP (Chemaxon):1.15

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue