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

Formula:C20H16N3O2Cl Mutagenic:low Tumorigenic:none Reproductive Effective:none 1-(2-chlorophenyl)-N-(2-hydroxyethyl)-9H-pyrido[3,4-b]indole-3-carboxamide is a drug-like molecule.

MolName	1-(2-chlorophenyl)-N-(2-hydroxyethyl)-9H-pyrido[3,4-b]indole-3-carboxamide
MolecularFormula	C20H16N3O2Cl
Smiles	OCCNC(c(nc1-c(cccc2)c2Cl)cc2c1[nH]c1c2cccc1)=O
InChI	InChI=1S/C20H16ClN3O2/c21-15-7-3-1-6-13(15)18-19-14(12-5-2-4-8-16(12)23-19)11-17(24-18)20(26)22-9-10-25/h1-8,11,23,25H,9-10H2,(H,22,26)
InChIK	KLIFVEHYRDYAIW-UHFFFAOYSA-N
TotalMolweight	365.819
Molweight	365.819
MonoisotopicMass	365.093104
CLogP	3.3436
CLogS	-5.183
H Acceptors	5
H Donors	3
TotalSurfaceArea	269.05
Relative PSA	0.23252
PolarSurfaceArea	78.01
Druglikeness	1.4176
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46154
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	3
Amides	1
Aromatic Nitrogens	2
StereoCon

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