Chemical ID: 4124421

C1CCC(CC1)C=NNC(=O)c2c(nnn2c3c(non3)N)CN4CCCC4
Chemical ID:
4124421
Name [?]:
3-(4-amino-1,2,5-oxadiazol-3-yl)-N-(cyclohexylmethyleneamino)-5-(pyrrolidin-1-ylmethyl)triazole-4-carboxamide
SMILES [?]:
C1CCC(CC1)C=NNC(=O)c2c(nnn2c3c(non3)N)CN4CCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H25N9O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.5114
Area:570.117
Solvation:-3.74157
Coulombic:-49.5623
Bond Count [?]
All:31
Single:25
Double:6
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:387.44
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:3.17
LogP (Chemaxon):0.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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