(E)-3-[4-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]prop-2-enoic acid

Formula:C13H10NO3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[4-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]prop-2-enoic acid is a drug-like molecule.

MolName	(E)-3-[4-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]prop-2-enoic acid
MolecularFormula	C13H10NO3ClS
Smiles	OC(/C=C/c(cc1)ccc1OCc(s1)cnc1Cl)=O
InChI	InChI=1S/C13H10ClNO3S/c14-13-15-7-11(19-13)8-18-10-4-1-9(2-5-10)3-6-12(16)17/h1-7H,8H2,(H,16,17)
InChIK	UKLCFGPTRPMMFQ-UHFFFAOYSA-N
TotalMolweight	295.745
Molweight	295.745
MonoisotopicMass	295.006991
CLogP	2.835
CLogS	-3.788
H Acceptors	4
H Donors	1
TotalSurfaceArea	217.5
Relative PSA	0.31021
PolarSurfaceArea	87.66
Druglikeness	2.0095
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.73684
Fragments	1
Non HAtoms	19
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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