Chemical ID: 6732412

c1ccc(cc1)CNC(=O)C(Cc2c[nH]c3c2cccc3)[NH3+]
Chemical ID:
6732412
Name [?]:
[1-(benzylcarbamoyl)-2-(1H-indol-3-yl)ethyl]ammonium
SMILES [?]:
c1ccc(cc1)CNC(=O)C(Cc2c[nH]c3c2cccc3)[NH3+]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H20N3O+
All Atoms:42
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:-26.6605
Area:514.936
Solvation:-39.5339
Coulombic:10.2668
Bond Count [?]
All:24
Single:16
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:294.371
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.36
LogP (Chemaxon):2.71

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue