(5-phenyl-1,3,4-oxadiazol-2-yl)methyl (3E)-3-(thiophen-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Formula:C27H19N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5-phenyl-1,3,4-oxadiazol-2-yl)methyl (3E)-3-(thiophen-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate is not a drug-like molecule.

MolName	(5-phenyl-1,3,4-oxadiazol-2-yl)methyl (3E)-3-(thiophen-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
MolecularFormula	C27H19N3O3S
Smiles	O=C(c1c(CC/C2=C\c3cccs3)c2nc2ccccc12)OCc1nnc(-c2ccccc2)o1
InChI	InChI=1S/C27H19N3O3S/c31-27(32-16-23-29-30-26(33-23)17-7-2-1-3-8-17)24-20-10-4-5-11-22(20)28-25-18(12-13-21(24)25)15-19-9-6-14-34-19/h1-11,14-15H,12-13,16H2
InChIK	GTNUBVSWNNKYIA-UHFFFAOYSA-N
TotalMolweight	465.532
Molweight	465.532
MonoisotopicMass	465.114712
CLogP	5.2535
CLogS	-7.017
H Acceptors	6
TotalSurfaceArea	349.29
Relative PSA	0.25887
PolarSurfaceArea	106.35
Druglikeness	1.7398
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	3
StereoCon

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1 - (5-phenyl-1,3,4-oxadiazol-2-yl)methyl (3E)-3-(thiophen-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate | 2 - (5-phenyl-1,3,4-oxadiazol-2-yl)methyl (3E)-3-(thiophen-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

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