N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-4,5-dihydro-2H-benzo[g]indazole-3-carboxamide

Formula:C21H18N4O Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-4,5-dihydro-2H-benzo[g]indazole-3-carboxamide is a drug-like molecule.

MolName	N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]-4,5-dihydro-2H-benzo[g]indazole-3-carboxamide
MolecularFormula	C21H18N4O
Smiles	O=C(c1c(CCc2c-3cccc2)c3n[nH]1)N/N=C\C=C\c1ccccc1
InChI	InChI=1S/C21H18N4O/c26-21(25-22-14-6-9-15-7-2-1-3-8-15)20-18-13-12-16-10-4-5-11-17(16)19(18)23-24-20/h1-11,14H,12-13H2,(H,23,24)(H,25,26)
InChIK	VYBSJYNVNDDSFF-UHFFFAOYSA-N
TotalMolweight	342.401
Molweight	342.401
MonoisotopicMass	342.148061
CLogP	3.3905
CLogS	-4.94
H Acceptors	5
H Donors	2
TotalSurfaceArea	275.6
Relative PSA	0.22123
PolarSurfaceArea	70.14
Druglikeness	4.7404
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	2
StereoCon

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