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4-Amino Salicylic Acid


  • SKU Code: CH137016
Chemical Name - 4-Amino Salicylic Acid
Mol Weight - 153.137
Smiles - Nc(cc1)cc(O)c1C(O)=O
Property Name Property Value
Mol Name4-Amino Salicylic Acid
Molweight153.137
Monoisotopic Mass153.042594
Clogp0.1217
Clogs-1.409
H Acceptors4
H Donors3
Total Surface Area112.23
Relative Psa0.4857
Polar Surface Area83.55
Druglikeness-1.5411
Mutagenichigh
Tumorigenichigh
Reproductive Effectivelow
Irritanthigh
Shape Index0.63636
Molecular Flexibility0.35822
Molecular Complexity0.6993
Fragments1
Non H Atoms11
Non Ch Atoms4
Electronegative Atoms4
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
Amines1
Aromatic Amines1
Acidic Oxygens1
SmilesNc(cc1)cc(O)c1C(O)=O
InChIKeyInChI=1S/C7H7NO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,8H2,(H,10,11)
InChIWUBBRNOQWQTFEX-UHFFFAOYSA-N

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