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AP-685/41280746 is available in 71 mg

Compound details
MDL #:		MFCD05157074
Formula:		C31 H31 N3 O3
Weight:		493.6
Salt Data:		2 HCl/H2O
Chiral info:		Not available
Name:		3-(9H-fluoren-9-ylidene)-1-{3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl}-2,5-pyrrolidinedione
SMILES:		COc1ccccc1N6CCN(CCCN2C(=O)CC(C2(=O))=C4c5ccccc5(c3ccccc34))CC6
InChI^TM:		InChI=1S/C31H31N3O3/c1-37-28-14-7-6-13-27(28)33-19-17-32(18-20-33)15-8-16-34-29(35)21-26(31(34)36)30-24-11-4-2-9-22(24)23-10-3-5-12-25(23)30/h2-7,9-14H,8,15-21H2,1H3
InChIKey^TM:		QVLZRPLBLMCLNA-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		1140 mg/Kg
Chronic LOAEL:		8.4 mg/Kg
AMES Mutagenicity:		1
Developmental Toxicity Potential:		0.02

Chemical properties calculations
LogP:	4.35	H-acceptors: 5
LogS:	-7.62
tPSA:	53.09 Å²	Rotatable bonds: 6

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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.