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Chemical ID: 6047759
Chemical ID:
6047759
Name [?]:
2-amino-2-(3-pyridyl)acetic acid
SMILES [?]:
c1cc(cnc1)C(C(=O)O)N
InChi [?]:
InChI=1/C7H8N2O2/c8-6(7(10)11)5-2-1-3-9-4-5/h1-4,6H,8H2,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,6,4,3,7,8,11,5,9,10/E:(10,11)/rA:11cCCCCNCCCOON/rB:s1;d2;s3;d4;d1s5;s3;s7;d8;s8;s7;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H8N2O2 |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 5.07638 |
Area: | 307.947 |
Solvation: | -2.6223 |
Coulombic: | -43.3022 |
Bond Count [?]
All: | 11 |
Single: | 7 |
Double: | 4 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 152.151 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 3 |
XLogP: | -3.03 |
LogP (Chemaxon): | -2.71 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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