1-phenyl-3-[2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]benzimidazol-1-yl]propan-1-one

Formula:C30H32N4O Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-phenyl-3-[2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]benzimidazol-1-yl]propan-1-one is a drug-like molecule.

MolName	1-phenyl-3-[2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]benzimidazol-1-yl]propan-1-one
MolecularFormula	C30H32N4O
Smiles	O=C(CCn1c(cccc2)c2nc1CN1CCN(C/C=C/c2ccccc2)CC1)c1ccccc1
InChI	InChI=1S/C30H32N4O/c35-29(26-13-5-2-6-14-26)17-19-34-28-16-8-7-15-27(28)31-30(34)24-33-22-20-32(21-23-33)18-9-12-25-10-3-1-4-11-25/h1-16H,17-24H2
InChIK	VIAYOUBFHWUVLW-UHFFFAOYSA-N
TotalMolweight	464.611
Molweight	464.611
MonoisotopicMass	464.257611
CLogP	4.4261
CLogS	-3.288
H Acceptors	5
TotalSurfaceArea	376.77
Relative PSA	0.1008
PolarSurfaceArea	41.37
Druglikeness	6.9717
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	35
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	10
Symmetricatoms	6
Amines	2
AlkylAmines	2
Aromatic Nitrogens	2
BasicNitrogens	3
StereoCon

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