5-(2,3-dichlorophenyl)-1-[(E)-2-phenylethenyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone

Formula:C28H17NO5Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:high 5-(2,3-dichlorophenyl)-1-[(E)-2-phenylethenyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone is not a drug-like molecule.

MolName	5-(2,3-dichlorophenyl)-1-[(E)-2-phenylethenyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
MolecularFormula	C28H17NO5Cl2
Smiles	O=C(C(C1C2=O)C(/C=C/c3ccccc3)OC1(C(c1c3cccc1)=O)C3=O)N2c1cccc(Cl)c1Cl
InChI	InChI=1S/C28H17Cl2NO5/c29-18-11-6-12-19(23(18)30)31-26(34)21-20(14-13-15-7-2-1-3-8-15)36-28(22(21)27(31)35)24(32)16-9-4-5-10-17(16)25(28)33/h1-14,20-22H/b14-13+
InChIK	SZHOIQKBLFLKSG-BUHFOSPRSA-N
TotalMolweight	518.351
Molweight	518.351
MonoisotopicMass	517.048378
CLogP	4.4276
CLogS	-7.512
H Acceptors	6
TotalSurfaceArea	348.83
Relative PSA	0.18837
PolarSurfaceArea	80.75
Druglikeness	3.3223
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Nasty Functions
Shape Index	0.38889
Fragments	1
Non HAtoms	36
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	3
Rotatable Bond	3
Rings Closures	6
Small Rings	6
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	7
Amides	1
StereoCon	unknown chirality

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1 - 5-(2,3-dichlorophenyl)-1-[(E)-2-phenylethenyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone | 2 - 5-(2,3-dichlorophenyl)-1-[(E)-2-phenylethenyl]spiro[3a,6a-dihydro-1H-furo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone

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