N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-thiophen-2-ylquinoline-4-carboxamide

Formula:C35H24N4OS Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-thiophen-2-ylquinoline-4-carboxamide is not a drug-like molecule.

MolName	N-[(Z)-(1,2-diphenylindol-3-yl)methylideneamino]-2-thiophen-2-ylquinoline-4-carboxamide
MolecularFormula	C35H24N4OS
Smiles	O=C(c1cc(-c2cccs2)nc2ccccc12)N/N=C\c(c1c2cccc1)c(-c1ccccc1)n2-c1ccccc1
InChI	InChI=1S/C35H24N4OS/c40-35(28-22-31(33-20-11-21-41-33)37-30-18-9-7-16-26(28)30)38-36-23-29-27-17-8-10-19-32(27)39(25-14-5-2-6-15-25)34(29)24-12-3-1-4-13-24/h1-23H,(H,38,40)
InChIK	RGNZETRLMIVDPV-UHFFFAOYSA-N
TotalMolweight	548.669
Molweight	548.669
MonoisotopicMass	548.167081
CLogP	8.5433
CLogS	-11.718
H Acceptors	5
H Donors	1
TotalSurfaceArea	419.37
Relative PSA	0.17696
PolarSurfaceArea	87.52
Druglikeness	6.8143
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.41463
Fragments	1
Non HAtoms	41
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	7
Small Rings	7
Aromatic Rings	7
Aromatic Atoms	36
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

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