[(Z)-2-[1-[2-(4-bromophenoxy)ethyl]benzimidazol-2-yl]-1-(4-chlorophenyl)ethenyl] 4-chlorobenzoate

Formula:C30H21N2O3BrCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-2-[1-[2-(4-bromophenoxy)ethyl]benzimidazol-2-yl]-1-(4-chlorophenyl)ethenyl] 4-chlorobenzoate is not a drug-like molecule.

MolName	[(Z)-2-[1-[2-(4-bromophenoxy)ethyl]benzimidazol-2-yl]-1-(4-chlorophenyl)ethenyl] 4-chlorobenzoate
MolecularFormula	C30H21N2O3BrCl2
Smiles	O=C(c(cc1)ccc1Cl)O/C(/c(cc1)ccc1Cl)=C\c1nc(cccc2)c2n1CCOc(cc1)ccc1Br
InChI	InChI=1S/C30H21BrCl2N2O3/c31-22-9-15-25(16-10-22)37-18-17-35-27-4-2-1-3-26(27)34-29(35)19-28(20-5-11-23(32)12-6-20)38-30(36)21-7-13-24(33)14-8-21/h1-16,19H,17-18H2
InChIK	AAUSCKOHUKDOQR-UHFFFAOYSA-N
TotalMolweight	608.318
Molweight	608.318
MonoisotopicMass	606.011258
CLogP	7.9237
CLogS	-7.284
H Acceptors	5
TotalSurfaceArea	414.55
Relative PSA	0.12274
PolarSurfaceArea	53.35
Druglikeness	0.77792
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	38
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	27
Sp3Atoms	4
Symmetricatoms	6
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - [(Z)-2-[1-[2-(4-bromophenoxy)ethyl]benzimidazol-2-yl]-1-(4-chlorophenyl)ethenyl] 4-chlorobenzoate | 2 - [(Z)-2-[1-[2-(4-bromophenoxy)ethyl]benzimidazol-2-yl]-1-(4-chlorophenyl)ethenyl] 4-chlorobenzoate

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