1-[(Z)-N'-(1,3-benzoxazol-2-yl)carbamimidoyl]-3-(3-chlorophenyl)urea

Formula:C15H12N5O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-[(Z)-N'-(1,3-benzoxazol-2-yl)carbamimidoyl]-3-(3-chlorophenyl)urea is a drug-like molecule.

MolName	1-[(Z)-N'-(1,3-benzoxazol-2-yl)carbamimidoyl]-3-(3-chlorophenyl)urea
MolecularFormula	C15H12N5O2Cl
Smiles	N/C(/NC(Nc1cccc(Cl)c1)=O)=N/c1nc(cccc2)c2o1
InChI	InChI=1S/C15H12ClN5O2/c16-9-4-3-5-10(8-9)18-14(22)20-13(17)21-15-19-11-6-1-2-7-12(11)23-15/h1-8H,(H4,17,18,19,20,21,22)
InChIK	RDABYHGADJWUAV-UHFFFAOYSA-N
TotalMolweight	329.746
Molweight	329.746
MonoisotopicMass	329.067952
CLogP	2.9543
CLogS	-5.752
H Acceptors	7
H Donors	3
TotalSurfaceArea	243.65
Relative PSA	0.36044
PolarSurfaceArea	105.54
Druglikeness	0.58134
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Amides	2
Aromatic Nitrogens	1
BasicNitrogens	1
StereoCon

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