(E)-3-(2-chlorophenyl)-N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]prop-2-enamide

Formula:C18H13N3OCl2S Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-3-(2-chlorophenyl)-N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-(2-chlorophenyl)-N-[5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]prop-2-enamide
MolecularFormula	C18H13N3OCl2S
Smiles	O=C(/C=C/c(cccc1)c1Cl)Nc1nnc(Cc(cc2)ccc2Cl)s1
InChI	InChI=1S/C18H13Cl2N3OS/c19-14-8-5-12(6-9-14)11-17-22-23-18(25-17)21-16(24)10-7-13-3-1-2-4-15(13)20/h1-10H,11H2,(H,21,23,24)
InChIK	LWSFGIZJJDLZHW-UHFFFAOYSA-N
TotalMolweight	390.293
Molweight	390.293
MonoisotopicMass	389.015636
CLogP	5.0072
CLogS	-5.888
H Acceptors	4
H Donors	1
TotalSurfaceArea	286.55
Relative PSA	0.23312
PolarSurfaceArea	83.12
Druglikeness	2.6631
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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