N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-fluorobenzamide

Formula:C19H21N3OClF Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-fluorobenzamide is a drug-like molecule.

MolName	N-[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]-2-fluorobenzamide
MolecularFormula	C19H21N3OClF
Smiles	CCN(CC1)CCN1c(ccc(NC(c(cccc1)c1F)=O)c1)c1Cl
InChI	InChI=1S/C19H21ClFN3O/c1-2-23-9-11-24(12-10-23)18-8-7-14(13-16(18)20)22-19(25)15-5-3-4-6-17(15)21/h3-8,13H,2,9-12H2,1H3,(H,22,25)
InChIK	ITGNZSJYGDPBMN-UHFFFAOYSA-N
TotalMolweight	361.847
Molweight	361.847
MonoisotopicMass	361.135717
CLogP	3.6986
CLogS	-4.083
H Acceptors	4
H Donors	1
TotalSurfaceArea	272.16
Relative PSA	0.11611
PolarSurfaceArea	35.58
Druglikeness	5.8236
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	2
Amides	1
Amines	2
AlkylAmines	1
Aromatic Amines	1
BasicNitrogens	1
StereoCon

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