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AI-942/25034748 is available in 28 mg

Compound details
MDL #:		MFCD00190856
Formula:		C10 H10 Cl N O3
Weight:		227.65
Chiral info:		Not available
Name:		[(chloroacetyl)amino](phenyl)acetic acid
SMILES:		OC(=O)C(NC(=O)CCl)c1ccccc1
InChI^TM:		InChI=1S/C10H10ClNO3/c11-6-8(13)12-9(10(14)15)7-4-2-1-3-5-7/h1-5,9H,6H2,(H,12,13)(H,14,15)
InChIKey^TM:		YZOSWXATEQPYKN-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		3620 mg/Kg
AMES Mutagenicity:		1
Developmental Toxicity Potential:		0.03

Chemical properties calculations
LogP:	1.19	H-acceptors: 4
LogS:	-1.88	H-donors: 2
tPSA:	66.4 Å²	Rotatable bonds: 5

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.