(5Z)-4-amino-5-[[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]methylidene]-1,3-thiazol-2-one

Formula:C25H20N4OS Mutagenic:high Tumorigenic:low Reproductive Effective:none (5Z)-4-amino-5-[[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]methylidene]-1,3-thiazol-2-one is a drug-like molecule.

MolName	(5Z)-4-amino-5-[[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]methylidene]-1,3-thiazol-2-one
MolecularFormula	C25H20N4OS
Smiles	NC(/C(/S1)=C/c(cc2)ccc2N(C(C2)c3ccccc3)N=C2c2ccccc2)=NC1=O
InChI	InChI=1S/C25H20N4OS/c26-24-23(31-25(30)27-24)15-17-11-13-20(14-12-17)29-22(19-9-5-2-6-10-19)16-21(28-29)18-7-3-1-4-8-18/h1-15,22H,16H2,(H2,26,27,30)/t22-/m0/s1
InChIK	ZNYJQSOSHHMUQS-QFIPXVFZSA-N
TotalMolweight	424.527
Molweight	424.527
MonoisotopicMass	424.135781
CLogP	4.4604
CLogS	-6.222
H Acceptors	5
H Donors	1
TotalSurfaceArea	316.75
Relative PSA	0.22848
PolarSurfaceArea	96.35
Druglikeness	4.1378
Mutagenic	high
Tumorigenic	low
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51613
Fragments	1
Non HAtoms	31
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	6
BasicNitrogens	1
StereoCon	racemate

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1 - (5Z)-4-amino-5-[[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]methylidene]-1,3-thiazol-2-one | 2 - (5Z)-4-amino-5-[[4-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)phenyl]methylidene]-1,3-thiazol-2-one

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