(E)-3-[[4-(4-chlorophenyl)-1H-pyrazol-5-yl]amino]-1-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-en-1-one

Formula:C22H14N3O2Cl3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[[4-(4-chlorophenyl)-1H-pyrazol-5-yl]amino]-1-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-3-[[4-(4-chlorophenyl)-1H-pyrazol-5-yl]amino]-1-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-en-1-one
MolecularFormula	C22H14N3O2Cl3
Smiles	O=C(/C=C/Nc([nH]nc1)c1-c(cc1)ccc1Cl)c1ccc(-c(ccc(Cl)c2)c2Cl)o1
InChI	InChI=1S/C22H14Cl3N3O2/c23-14-3-1-13(2-4-14)17-12-27-28-22(17)26-10-9-19(29)21-8-7-20(30-21)16-6-5-15(24)11-18(16)25/h1-12H,(H2,26,27,28)
InChIK	OZYFMPMWCGNRGB-UHFFFAOYSA-N
TotalMolweight	458.731
Molweight	458.731
MonoisotopicMass	457.015158
CLogP	5.1356
CLogS	-8.638
H Acceptors	5
H Donors	2
TotalSurfaceArea	332.53
Relative PSA	0.19117
PolarSurfaceArea	70.92
Druglikeness	4.799
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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