4-nitro-N'-[2-[3-(trifluoromethyl)phenyl]acetyl]benzohydrazide

Formula:C16H12N3O4F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-nitro-N'-[2-[3-(trifluoromethyl)phenyl]acetyl]benzohydrazide is a drug-like molecule.

MolName	4-nitro-N'-[2-[3-(trifluoromethyl)phenyl]acetyl]benzohydrazide
MolecularFormula	C16H12N3O4F3
Smiles	[O-][N+](c(cc1)ccc1C(NNC(Cc1cccc(C(F)(F)F)c1)=O)=O)=O
InChI	InChI=1S/C16H12F3N3O4/c17-16(18,19)12-3-1-2-10(8-12)9-14(23)20-21-15(24)11-4-6-13(7-5-11)22(25)26/h1-8H,9H2,(H,20,23)(H,21,24)
InChIK	KBUKRZVJULDHOI-UHFFFAOYSA-N
TotalMolweight	367.282
Molweight	367.282
MonoisotopicMass	367.077991
CLogP	1.5424
CLogS	-4.513
H Acceptors	7
H Donors	2
TotalSurfaceArea	258.33
Relative PSA	0.30744
PolarSurfaceArea	104.02
Druglikeness	-10.631
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	4
AcidicOxygens	1
StereoCon

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