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

Formula:C25H25N4O2F Mutagenic:low Tumorigenic:none Reproductive Effective:none 1-(4-fluorophenyl)-N-(3-morpholin-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide is a drug-like molecule.

MolName	1-(4-fluorophenyl)-N-(3-morpholin-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide
MolecularFormula	C25H25N4O2F
Smiles	O=C(c(nc1-c(cc2)ccc2F)cc2c1[nH]c1c2cccc1)NCCCN1CCOCC1
InChI	InChI=1S/C25H25FN4O2/c26-18-8-6-17(7-9-18)23-24-20(19-4-1-2-5-21(19)28-24)16-22(29-23)25(31)27-10-3-11-30-12-14-32-15-13-30/h1-2,4-9,16,28H,3,10-15H2,(H,27,31)
InChIK	IEXIRHAWCYSYOZ-UHFFFAOYSA-N
TotalMolweight	432.498
Molweight	432.498
MonoisotopicMass	432.196154
CLogP	3.482
CLogS	-4.728
H Acceptors	6
H Donors	2
TotalSurfaceArea	329.23
Relative PSA	0.19139
PolarSurfaceArea	70.25
Druglikeness	1.8946
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53125
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	9
Symmetricatoms	4
Amides	1
Amines	1
AlkylAmines	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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