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

Formula:C25H17N3OClF Mutagenic:low Tumorigenic:none Reproductive Effective:none 1-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]-9H-pyrido[3,4-b]indole-3-carboxamide is not a drug-like molecule.

MolName	1-(2-chlorophenyl)-N-[(4-fluorophenyl)methyl]-9H-pyrido[3,4-b]indole-3-carboxamide
MolecularFormula	C25H17N3OClF
Smiles	O=C(c(nc1-c(cccc2)c2Cl)cc2c1[nH]c1c2cccc1)NCc(cc1)ccc1F
InChI	InChI=1S/C25H17ClFN3O/c26-20-7-3-1-6-18(20)23-24-19(17-5-2-4-8-21(17)29-24)13-22(30-23)25(31)28-14-15-9-11-16(27)12-10-15/h1-13,29H,14H2,(H,28,31)
InChIK	RCSOSHMVPIGUTE-UHFFFAOYSA-N
TotalMolweight	429.881
Molweight	429.881
MonoisotopicMass	429.104417
CLogP	5.3829
CLogS	-7.027
H Acceptors	4
H Donors	2
TotalSurfaceArea	315.05
Relative PSA	0.15699
PolarSurfaceArea	57.78
Druglikeness	0.014085
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	1
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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