Chemical ID: 3968766

CN(C)c1ccc2c(c1)oc-3cc(=[N+](C)C)ccc3c2c4ccc(cc4C(=O)O)N
Chemical ID:
3968766
Name [?]:
[9-(4-amino-2-carboxy-phenyl)-6-dimethylamino-xanthen-3-ylidene]-dimethyl-ammonium
SMILES [?]:
CN(C)c1ccc2c(c1)oc-3cc(=[N+](C)C)ccc3c2c4ccc(cc4C(=O)O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H24N3O3+
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:-16.0553
Area:607.161
Solvation:-31.2343
Coulombic:-35.0424
Bond Count [?]
All:33
Single:22
Double:11
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:402.466
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:3.43
LogP (Chemaxon):0.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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