N-[(Z)-(3-phenoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

Formula:C21H20N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(3-phenoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide is a drug-like molecule.

MolName	N-[(Z)-(3-phenoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
MolecularFormula	C21H20N4O2
Smiles	O=C(c1n[nH]c2c1CCCC2)N/N=C\c1cc(Oc2ccccc2)ccc1
InChI	InChI=1S/C21H20N4O2/c26-21(20-18-11-4-5-12-19(18)23-24-20)25-22-14-15-7-6-10-17(13-15)27-16-8-2-1-3-9-16/h1-3,6-10,13-14H,4-5,11-12H2,(H,23,24)(H,25,26)
InChIK	NVQAVACVYQQYCN-UHFFFAOYSA-N
TotalMolweight	360.416
Molweight	360.416
MonoisotopicMass	360.158626
CLogP	3.7556
CLogS	-5.731
H Acceptors	6
H Donors	2
TotalSurfaceArea	286.62
Relative PSA	0.24761
PolarSurfaceArea	79.37
Druglikeness	1.07
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.62963
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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