[(E)-2-[1-(4-bromophenyl)tetrazol-5-yl]ethylideneamino]thiourea

Formula:C10H10N7BrS Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-2-[1-(4-bromophenyl)tetrazol-5-yl]ethylideneamino]thiourea is a drug-like molecule.

MolName	[(E)-2-[1-(4-bromophenyl)tetrazol-5-yl]ethylideneamino]thiourea
MolecularFormula	C10H10N7BrS
Smiles	NC(N/N=C/Cc1nnnn1-c(cc1)ccc1Br)=S
InChI	InChI=1S/C10H10BrN7S/c11-7-1-3-8(4-2-7)18-9(14-16-17-18)5-6-13-15-10(12)19/h1-4,6H,5H2,(H3,12,15,19)
InChIK	PIWMMGCNEQPTHI-UHFFFAOYSA-N
TotalMolweight	340.208
Molweight	340.208
MonoisotopicMass	338.990174
CLogP	0.7325
CLogS	-3.202
H Acceptors	7
H Donors	2
TotalSurfaceArea	228.34
Relative PSA	0.46431
PolarSurfaceArea	126.1
Druglikeness	-0.033645
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde; thio-amide/urea
Shape Index	0.68421
Fragments	1
Non HAtoms	19
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	4
StereoCon

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