1-[(E)-[amino(pyridin-2-yl)methylidene]amino]-3-(4-chlorophenyl)urea

Formula:C13H12N5OCl Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-[(E)-[amino(pyridin-2-yl)methylidene]amino]-3-(4-chlorophenyl)urea is a drug-like molecule.

MolName	1-[(E)-[amino(pyridin-2-yl)methylidene]amino]-3-(4-chlorophenyl)urea
MolecularFormula	C13H12N5OCl
Smiles	N/C(/c1ncccc1)=N/NC(Nc(cc1)ccc1Cl)=O
InChI	InChI=1S/C13H12ClN5O/c14-9-4-6-10(7-5-9)17-13(20)19-18-12(15)11-3-1-2-8-16-11/h1-8H,(H2,15,18)(H2,17,19,20)
InChIK	ZVNIOMADNCZDKJ-UHFFFAOYSA-N
TotalMolweight	289.725
Molweight	289.725
MonoisotopicMass	289.073037
CLogP	2.0086
CLogS	-3.967
H Acceptors	6
H Donors	3
TotalSurfaceArea	219.36
Relative PSA	0.33602
PolarSurfaceArea	92.4
Druglikeness	2.451
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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