(Z)-1-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(1H-1,2,4-triazol-5-yl)methanimine

Formula:C13H8N4OCl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high (Z)-1-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(1H-1,2,4-triazol-5-yl)methanimine is a drug-like molecule.

MolName	(Z)-1-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(1H-1,2,4-triazol-5-yl)methanimine
MolecularFormula	C13H8N4OCl2
Smiles	Clc(cc1)cc(-c2ccc(/C=N\c3ncn[nH]3)o2)c1Cl
InChI	InChI=1S/C13H8Cl2N4O/c14-8-1-3-11(15)10(5-8)12-4-2-9(20-12)6-16-13-17-7-18-19-13/h1-7H,(H,17,18,19)
InChIK	KTELCJHOASDSAF-UHFFFAOYSA-N
TotalMolweight	307.14
Molweight	307.14
MonoisotopicMass	306.007515
CLogP	3.3237
CLogS	-5.311
H Acceptors	5
H Donors	1
TotalSurfaceArea	225.16
Relative PSA	0.27336
PolarSurfaceArea	67.07
Druglikeness	4.4149
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Aromatic Nitrogens	3
StereoCon

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1 - (Z)-1-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(1H-1,2,4-triazol-5-yl)methanimine | 2 - (Z)-1-[5-(2,5-dichlorophenyl)furan-2-yl]-N-(1H-1,2,4-triazol-5-yl)methanimine

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