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Chemical ID: 7678960
Chemical ID:
7678960
Name [?]:
None
SMILES [?]:
CC1=Nn2c3ccccc3nc2NC(=O)C1
InChi [?]:
InChI=1/C11H10N4O/c1-7-6-10(16)13-11-12-8-4-2-3-5-9(8)15(11)14-7/h2-5H,6H2,1H3,(H,12,13,16)
InChi Info:
AuxInfo=1/1/N:1,8,7,9,6,16,2,10,5,14,12,11,13,3,4,15/rA:16nCCNNCCCCCCNCNCOC/rB:s1;d2;s3;s4;s5;d6;s7;d8;d5s9;s10;s4d11;s12;s13;d14;s2s14;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H10N4O |
All Atoms: | 26 |
Heavy Atoms: | 16 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 7.02578 |
Area: | 370.51 |
Solvation: | -2.23696 |
Coulombic: | -31.0599 |
Bond Count [?]
All: | 18 |
Single: | 12 |
Double: | 6 |
Rotors: | 0 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 0.74 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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