(10'Z)-3'-phenylsulfanylspiro[1,3-dioxolane-2,4'-2,3,3a,5,6,7,8,9-octahydro-1H-cyclopenta[9]annulene]

Formula:C20H26O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (10'Z)-3'-phenylsulfanylspiro[1,3-dioxolane-2,4'-2,3,3a,5,6,7,8,9-octahydro-1H-cyclopenta[9]annulene] is not a drug-like molecule.

MolName	(10'Z)-3'-phenylsulfanylspiro[1,3-dioxolane-2,4'-2,3,3a,5,6,7,8,9-octahydro-1H-cyclopenta[9]annulene]
MolecularFormula	C20H26O2S
Smiles	C(C/C(/C12)=C/CCCCCC11OCCO1)C2Sc1ccccc1
InChI	InChI=1S/C20H26O2S/c1-2-7-13-20(21-14-15-22-20)19-16(8-4-1)11-12-18(19)23-17-9-5-3-6-10-17/h3,5-6,8-10,18-19H,1-2,4,7,11-15H2/b16-8-
InChIK	IFZRGLLWHBHOTE-PXNMLYILSA-N
TotalMolweight	330.49
Molweight	330.49
MonoisotopicMass	330.16535
CLogP	5.1126
CLogS	-4.696
H Acceptors	2
TotalSurfaceArea	254.21
Relative PSA	0.14748
PolarSurfaceArea	43.76
Druglikeness	-10.211
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.47826
Fragments	1
Non HAtoms	23
NonCHAtoms	3
Electronegative Atoms	3
StereoCenters	2
Rotatable Bond	2
Rings Closures	4
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	15
Symmetricatoms	4
StereoCon	unknown chirality

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1 - (10'Z)-3'-phenylsulfanylspiro[1,3-dioxolane-2,4'-2,3,3a,5,6,7,8,9-octahydro-1H-cyclopenta[9]annulene] | 2 - (10'Z)-3'-phenylsulfanylspiro[1,3-dioxolane-2,4'-2,3,3a,5,6,7,8,9-octahydro-1H-cyclopenta[9]annulene]

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