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

Formula:C12H11N6OCl Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-[(E)-[amino(pyrazin-2-yl)methylidene]amino]-3-(4-chlorophenyl)urea is a drug-like molecule.

MolName	1-[(E)-[amino(pyrazin-2-yl)methylidene]amino]-3-(4-chlorophenyl)urea
MolecularFormula	C12H11N6OCl
Smiles	N/C(/c1nccnc1)=N/NC(Nc(cc1)ccc1Cl)=O
InChI	InChI=1S/C12H11ClN6O/c13-8-1-3-9(4-2-8)17-12(20)19-18-11(14)10-7-15-5-6-16-10/h1-7H,(H2,14,18)(H2,17,19,20)
InChIK	AEIAGCIHMLLHJD-UHFFFAOYSA-N
TotalMolweight	290.713
Molweight	290.713
MonoisotopicMass	290.068286
CLogP	1.0077
CLogS	-3.172
H Acceptors	7
H Donors	3
TotalSurfaceArea	218.12
Relative PSA	0.38823
PolarSurfaceArea	105.29
Druglikeness	2.451
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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