Chemical ID: 4759813

c1ccc2c(c1)CC([NH2+]C2)C(=O)O
Chemical ID:
4759813
Name [?]:
3,4-dihydro-1H-isoquinoline-3-carboxylic acid
SMILES [?]:
c1ccc2c(c1)CC([NH2+]C2)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C10H12NO2+
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:-26.482
Area:334.29
Solvation:-34.8392
Coulombic:11.0462
Bond Count [?]
All:14
Single:10
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:178.208
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:0.87
LogP (Chemaxon):-1.16

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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