Chemical ID: 4158388

Cc1c(sc2c1c(ncn2)NCC(=O)O)C
Chemical ID:
4158388
Name [?]:
2-[(7,8-dimethyl-9-thia-2,4-diazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-yl)amino]acetic acid
SMILES [?]:
Cc1c(sc2c1c(ncn2)NCC(=O)O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C10H11N3O2S
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.77321
Area:399.472
Solvation:-2.21358
Coulombic:-49.2229
Bond Count [?]
All:17
Single:12
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:237.279
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:0.34
LogP (Chemaxon):1.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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