2,4-dichloro-N-[(E)-1-(1,3-diphenylpyrazol-4-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide

Formula:C25H19N5O2Cl2 Mutagenic:none Tumorigenic:high Reproductive Effective:none 2,4-dichloro-N-[(E)-1-(1,3-diphenylpyrazol-4-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	2,4-dichloro-N-[(E)-1-(1,3-diphenylpyrazol-4-yl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C25H19N5O2Cl2
Smiles	NNC(/C(/NC(c(ccc(Cl)c1)c1Cl)=O)=C\c1cn(-c2ccccc2)nc1-c1ccccc1)=O
InChI	InChI=1S/C25H19Cl2N5O2/c26-18-11-12-20(21(27)14-18)24(33)29-22(25(34)30-28)13-17-15-32(19-9-5-2-6-10-19)31-23(17)16-7-3-1-4-8-16/h1-15H,28H2,(H,29,33)(H,30,34)
InChIK	ABTGGHLOQZKJRF-UHFFFAOYSA-N
TotalMolweight	492.365
Molweight	492.365
MonoisotopicMass	491.091579
CLogP	3.7305
CLogS	-6.712
H Acceptors	7
H Donors	3
TotalSurfaceArea	362.99
Relative PSA	0.2262
PolarSurfaceArea	102.04
Druglikeness	-0.38866
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	hydrazine
Shape Index	0.47059
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	1
Symmetricatoms	4
Amides	1
Aromatic Nitrogens	2
StereoCon

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