N-[(Z)-(3-oxocyclohexylidene)amino]-3-phenyl-1H-pyrazole-5-carboxamide

Formula:C16H16N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(3-oxocyclohexylidene)amino]-3-phenyl-1H-pyrazole-5-carboxamide is a drug-like molecule.

MolName	N-[(Z)-(3-oxocyclohexylidene)amino]-3-phenyl-1H-pyrazole-5-carboxamide
MolecularFormula	C16H16N4O2
Smiles	O=C(c1cc(-c2ccccc2)n[nH]1)N/N=C(/CCC1)\CC1=O
InChI	InChI=1S/C16H16N4O2/c21-13-8-4-7-12(9-13)17-20-16(22)15-10-14(18-19-15)11-5-2-1-3-6-11/h1-3,5-6,10H,4,7-9H2,(H,18,19)(H,20,22)
InChIK	OTTQZZGTEJUUFS-UHFFFAOYSA-N
TotalMolweight	296.329
Molweight	296.329
MonoisotopicMass	296.127326
CLogP	1.9417
CLogS	-3.61
H Acceptors	6
H Donors	2
TotalSurfaceArea	232.82
Relative PSA	0.31789
PolarSurfaceArea	87.21
Druglikeness	0.18038
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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