[1-(2-chlorophenyl)-9H-pyrido[3,4-b]indol-3-yl]-morpholin-4-ylmethanone

Formula:C22H18N3O2Cl Mutagenic:low Tumorigenic:none Reproductive Effective:none [1-(2-chlorophenyl)-9H-pyrido[3,4-b]indol-3-yl]-morpholin-4-ylmethanone is a drug-like molecule.

MolName	[1-(2-chlorophenyl)-9H-pyrido[3,4-b]indol-3-yl]-morpholin-4-ylmethanone
MolecularFormula	C22H18N3O2Cl
Smiles	O=C(c(nc1-c(cccc2)c2Cl)cc2c1[nH]c1c2cccc1)N1CCOCC1
InChI	InChI=1S/C22H18ClN3O2/c23-17-7-3-1-6-15(17)20-21-16(14-5-2-4-8-18(14)24-21)13-19(25-20)22(27)26-9-11-28-12-10-26/h1-8,13,24H,9-12H2
InChIK	RQGXCLVRVVJZFC-UHFFFAOYSA-N
TotalMolweight	391.857
Molweight	391.857
MonoisotopicMass	391.108754
CLogP	4.0995
CLogS	-5.095
H Acceptors	5
H Donors	1
TotalSurfaceArea	285.56
Relative PSA	0.18052
PolarSurfaceArea	58.22
Druglikeness	2.9642
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.42857
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	5
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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