N-[(Z)-1-anthracen-9-yl-3-oxo-3-(2-phenylhydrazinyl)prop-1-en-2-yl]benzamide

Formula:C30H23N3O2 Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-1-anthracen-9-yl-3-oxo-3-(2-phenylhydrazinyl)prop-1-en-2-yl]benzamide is not a drug-like molecule.

MolNameN-[(Z)-1-anthracen-9-yl-3-oxo-3-(2-phenylhydrazinyl)prop-1-en-2-yl]benzamide
MolecularFormulaC30H23N3O2
SmilesO=C(/C(/NC(c1ccccc1)=O)=C/c1c(cccc2)c2cc2ccccc12)NNc1ccccc1
InChIInChI=1S/C30H23N3O2/c34-29(21-11-3-1-4-12-21)31-28(30(35)33-32-24-15-5-2-6-16-24)20-27-25-17-9-7-13-22(25)19-23-14-8-10-18-26(23)27/h1-20,32H,(H,31,34)(H,33,35)
InChIKXDIRSMJDIBQTSH-UHFFFAOYSA-N
TotalMolweight457.532
Molweight457.532
MonoisotopicMass457.179027
CLogP7.2624
CLogS-7.695
H Acceptors5
H Donors3
TotalSurfaceArea356.57
Relative PSA0.16956
PolarSurfaceArea70.23
Druglikeness4.2429
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritanthigh
Nasty Functions
Shape Index0.4
Fragments1
Non HAtoms35
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond6
Rings Closures5
Small Rings5
Aromatic Rings5
Aromatic Atoms26
Symmetricatoms10
Amides1
StereoCon

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