(Z)-3-phenyl-N-(1,2,4-triazol-4-yl)propan-1-imine

Formula:C11H12N4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-phenyl-N-(1,2,4-triazol-4-yl)propan-1-imine is a drug-like molecule.

MolName	(Z)-3-phenyl-N-(1,2,4-triazol-4-yl)propan-1-imine
MolecularFormula	C11H12N4
Smiles	C(Cc1ccccc1)/C=N\n1cnnc1
InChI	InChI=1S/C11H12N4/c1-2-5-11(6-3-1)7-4-8-14-15-9-12-13-10-15/h1-3,5-6,8-10H,4,7H2
InChIK	QHXRYVFULKMUBQ-UHFFFAOYSA-N
TotalMolweight	200.244
Molweight	200.244
MonoisotopicMass	200.106196
CLogP	1.3699
CLogS	-4.467
H Acceptors	4
TotalSurfaceArea	172.02
Relative PSA	0.23439
PolarSurfaceArea	43.07
Druglikeness	2.582
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.73333
Fragments	1
Non HAtoms	15
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	3
StereoCon

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