1-(4-fluorophenyl)-N-[2-(4-fluorophenyl)ethyl]-9H-pyrido[3,4-b]indole-3-carboxamide

Formula:C26H19N3OF2 Mutagenic:low Tumorigenic:none Reproductive Effective:none 1-(4-fluorophenyl)-N-[2-(4-fluorophenyl)ethyl]-9H-pyrido[3,4-b]indole-3-carboxamide is not a drug-like molecule.

MolName	1-(4-fluorophenyl)-N-[2-(4-fluorophenyl)ethyl]-9H-pyrido[3,4-b]indole-3-carboxamide
MolecularFormula	C26H19N3OF2
Smiles	O=C(c(nc1-c(cc2)ccc2F)cc2c1[nH]c1c2cccc1)NCCc(cc1)ccc1F
InChI	InChI=1S/C26H19F2N3O/c27-18-9-5-16(6-10-18)13-14-29-26(32)23-15-21-20-3-1-2-4-22(20)30-25(21)24(31-23)17-7-11-19(28)12-8-17/h1-12,15,30H,13-14H2,(H,29,32)
InChIK	IKCNTQDUJRRIMV-UHFFFAOYSA-N
TotalMolweight	427.453
Molweight	427.453
MonoisotopicMass	427.149618
CLogP	5.3078
CLogS	-6.717
H Acceptors	4
H Donors	2
TotalSurfaceArea	319.74
Relative PSA	0.15469
PolarSurfaceArea	57.78
Druglikeness	0.0569
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53125
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
Symmetricatoms	4
Amides	1
Aromatic Nitrogens	2
StereoCon

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