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

Formula:C30H27N4OF Mutagenic:low Tumorigenic:none Reproductive Effective:none N-(1-benzylpiperidin-4-yl)-1-(4-fluorophenyl)-9H-pyrido[3,4-b]indole-3-carboxamide is not a drug-like molecule.

MolName	N-(1-benzylpiperidin-4-yl)-1-(4-fluorophenyl)-9H-pyrido[3,4-b]indole-3-carboxamide
MolecularFormula	C30H27N4OF
Smiles	O=C(c(nc1-c(cc2)ccc2F)cc2c1[nH]c1c2cccc1)NC1CCN(Cc2ccccc2)CC1
InChI	InChI=1S/C30H27FN4O/c31-22-12-10-21(11-13-22)28-29-25(24-8-4-5-9-26(24)33-29)18-27(34-28)30(36)32-23-14-16-35(17-15-23)19-20-6-2-1-3-7-20/h1-13,18,23,33H,14-17,19H2,(H,32,36)
InChIK	WTYXCNCOYGIRPV-UHFFFAOYSA-N
TotalMolweight	478.569
Molweight	478.569
MonoisotopicMass	478.216889
CLogP	5.278
CLogS	-6.478
H Acceptors	5
H Donors	2
TotalSurfaceArea	363.97
Relative PSA	0.14564
PolarSurfaceArea	61.02
Druglikeness	6.745
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52778
Fragments	1
Non HAtoms	36
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	6
Small Rings	6
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	7
Symmetricatoms	6
Amides	1
Amines	1
AlkylAmines	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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