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

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

MolName	1-(4-fluorophenyl)-N-[2-(3-fluorophenyl)ethyl]-9H-pyrido[3,4-b]indole-3-carboxamide
MolecularFormula	C26H19N3OF2
Smiles	O=C(c1nc(-c(cc2)ccc2F)c2[nH]c(cccc3)c3c2c1)NCCc1cccc(F)c1
InChI	InChI=1S/C26H19F2N3O/c27-18-10-8-17(9-11-18)24-25-21(20-6-1-2-7-22(20)30-25)15-23(31-24)26(32)29-13-12-16-4-3-5-19(28)14-16/h1-11,14-15,30H,12-13H2,(H,29,32)
InChIK	QULYYQNGSBHFEF-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	0.5
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	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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