(Z)-7-[3-hydroxy-2-[(E)-3-hydroxy-5-phenylpent-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid

Formula:C23H30O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-7-[3-hydroxy-2-[(E)-3-hydroxy-5-phenylpent-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid is a drug-like molecule.

MolName(Z)-7-[3-hydroxy-2-[(E)-3-hydroxy-5-phenylpent-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
MolecularFormulaC23H30O5
SmilesOC(CCc1ccccc1)/C=C/C(C(C/C=C\CCCC(O)=O)C(C1)=O)C1O
InChIInChI=1S/C23H30O5/c24-18(13-12-17-8-4-3-5-9-17)14-15-20-19(21(25)16-22(20)26)10-6-1-2-7-11-23(27)28/h1,3-6,8-9,14-15,18-20,22,24,26H,2,7,10-13,16H2,(H,27,28)
InChIKFOBVMYJQWZOGGJ-UHFFFAOYSA-N
TotalMolweight386.486
Molweight386.486
MonoisotopicMass386.209325
CLogP3.8715
CLogS-3.908
H Acceptors5
H Donors3
TotalSurfaceArea313.63
Relative PSA0.20846
PolarSurfaceArea94.83
Druglikeness-7.3598
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.67857
Fragments1
Non HAtoms28
NonCHAtoms5
Electronegative Atoms5
StereoCenters4
Rotatable Bond11
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms14
Symmetricatoms2
AcidicOxygens1
StereoConunknown chirality

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