2-[4-[(E)-2-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]ethenyl]phenyl]-5-phenyl-1,3-oxazole

Formula:C38H29N3O Mutagenic:high Tumorigenic:low Reproductive Effective:none 2-[4-[(E)-2-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]ethenyl]phenyl]-5-phenyl-1,3-oxazole is not a drug-like molecule.

MolName	2-[4-[(E)-2-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]ethenyl]phenyl]-5-phenyl-1,3-oxazole
MolecularFormula	C38H29N3O
Smiles	C(C1c2ccccc2)C(c2ccccc2)=NN1c1ccc(/C=C/c(cc2)ccc2-c2ncc(-c3ccccc3)o2)cc1
InChI	InChI=1S/C38H29N3O/c1-4-10-30(11-5-1)35-26-36(31-12-6-2-7-13-31)41(40-35)34-24-20-29(21-25-34)17-16-28-18-22-33(23-19-28)38-39-27-37(42-38)32-14-8-3-9-15-32/h1-25,27,36H,26H2/t36-/m0/s1
InChIK	CPZVZALHDJVGJO-BHVANESWSA-N
TotalMolweight	543.668
Molweight	543.668
MonoisotopicMass	543.231062
CLogP	9.2946
CLogS	-10.057
H Acceptors	4
TotalSurfaceArea	433.04
Relative PSA	0.092694
PolarSurfaceArea	41.63
Druglikeness	2.7414
Mutagenic	high
Tumorigenic	low
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	42
NonCHAtoms	4
Electronegative Atoms	4
StereoCenters	1
Rotatable Bond	7
Rings Closures	7
Small Rings	7
Aromatic Rings	6
Aromatic Atoms	35
Sp3Atoms	2
Symmetricatoms	10
Aromatic Nitrogens	1
StereoCon	racemate

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1 - 2-[4-[(E)-2-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]ethenyl]phenyl]-5-phenyl-1,3-oxazole | 2 - 2-[4-[(E)-2-[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]ethenyl]phenyl]-5-phenyl-1,3-oxazole

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