(Z)-2-(2,4-dichlorophenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile

Formula:C24H15N3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:low (Z)-2-(2,4-dichlorophenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-2-(2,4-dichlorophenyl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enenitrile
MolecularFormula	C24H15N3Cl2
Smiles	N#C/C(/c(ccc(Cl)c1)c1Cl)=C\c1cn(-c2ccccc2)nc1-c1ccccc1
InChI	InChI=1S/C24H15Cl2N3/c25-20-11-12-22(23(26)14-20)18(15-27)13-19-16-29(21-9-5-2-6-10-21)28-24(19)17-7-3-1-4-8-17/h1-14,16H
InChIK	MRZXKYMGVWYEDW-UHFFFAOYSA-N
TotalMolweight	416.31
Molweight	416.31
MonoisotopicMass	415.064301
CLogP	5.4636
CLogS	-6.614
H Acceptors	3
TotalSurfaceArea	317.76
Relative PSA	0.098817
PolarSurfaceArea	41.61
Druglikeness	-1.6437
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

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