1-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2-(3,3,3-trifluoroprop-1-en-2-yl)hydrazine

Formula:C12H9N4O2F3S Mutagenic:none Tumorigenic:high Reproductive Effective:none 1-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2-(3,3,3-trifluoroprop-1-en-2-yl)hydrazine is a drug-like molecule.

MolName	1-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2-(3,3,3-trifluoroprop-1-en-2-yl)hydrazine
MolecularFormula	C12H9N4O2F3S
Smiles	C=C(C(F)(F)F)NNc1nc(-c(cc2)ccc2[N+]([O-])=O)cs1
InChI	InChI=1S/C12H9F3N4O2S/c1-7(12(13,14)15)17-18-11-16-10(6-22-11)8-2-4-9(5-3-8)19(20)21/h2-6,17H,1H2,(H,16,18)
InChIK	HHAKJAZUYRYHJS-UHFFFAOYSA-N
TotalMolweight	330.289
Molweight	330.289
MonoisotopicMass	330.03983
CLogP	3.9594
CLogS	-4.944
H Acceptors	6
H Donors	2
TotalSurfaceArea	226.52
Relative PSA	0.37379
PolarSurfaceArea	111.01
Druglikeness	-12.544
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	4
Aromatic Nitrogens	1
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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