(E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl azide

Formula:C19H12N6O Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl azide is a drug-like molecule.

MolName	(E)-2-cyano-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl azide
MolecularFormula	C19H12N6O
Smiles	[N-]=[N+]=NC(/C(/C#N)=C/c1cn(-c2ccccc2)nc1-c1ccccc1)=O
InChI	InChI=1S/C19H12N6O/c20-12-15(19(26)22-24-21)11-16-13-25(17-9-5-2-6-10-17)23-18(16)14-7-3-1-4-8-14/h1-11,13H
InChIK	USRLUEBAAMXDDD-UHFFFAOYSA-N
TotalMolweight	340.345
Molweight	340.345
MonoisotopicMass	340.107259
CLogP	2.4764
CLogS	-4.115
H Acceptors	7
TotalSurfaceArea	275.55
Relative PSA	0.29697
PolarSurfaceArea	84.64
Druglikeness	-0.41722
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

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