(E)-3-(4-bromophenyl)-N-(2H-tetrazol-5-yl)prop-2-enamide

Formula:C10H8N5OBr Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)-N-(2H-tetrazol-5-yl)prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(4-bromophenyl)-N-(2H-tetrazol-5-yl)prop-2-enamide
MolecularFormula	C10H8N5OBr
Smiles	O=C(/C=C/c(cc1)ccc1Br)Nc1n[nH]nn1
InChI	InChI=1S/C10H8BrN5O/c11-8-4-1-7(2-5-8)3-6-9(17)12-10-13-15-16-14-10/h1-6H,(H2,12,13,14,15,16,17)
InChIK	PGXREIQDEQZWFO-UHFFFAOYSA-N
TotalMolweight	294.112
Molweight	294.112
MonoisotopicMass	292.991221
CLogP	1.8544
CLogS	-3.74
H Acceptors	6
H Donors	2
TotalSurfaceArea	193.21
Relative PSA	0.36955
PolarSurfaceArea	83.56
Druglikeness	-4.9775
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.70588
Fragments	1
Non HAtoms	17
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	4
StereoCon

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