(6Z,12Z)-6,12-diphenylbenzo[c][1,5]benzodiazocine

Formula:C26H18N2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (6Z,12Z)-6,12-diphenylbenzo[c][1,5]benzodiazocine is a drug-like molecule.

MolName(6Z,12Z)-6,12-diphenylbenzo[c][1,5]benzodiazocine
MolecularFormulaC26H18N2
Smilesc(cc1)ccc1/C1=C(\C=CC=C2)/C2=N\C(\c2ccccc2)=C(\C=CC=C2)/C2=N1
InChIInChI=1S/C26H18N2/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)28-26(20-13-5-2-6-14-20)22-16-8-10-18-24(22)27-25/h1-18H
InChIKUQIGJMYREVNYFW-UHFFFAOYSA-N
TotalMolweight358.443
Molweight358.443
MonoisotopicMass358.146998
CLogP4.6342
CLogS-4.834
H Acceptors2
TotalSurfaceArea290.3
Relative PSA0.079297
PolarSurfaceArea24.72
Druglikeness0.9875
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.46429
Fragments1
Non HAtoms28
NonCHAtoms2
Electronegative Atoms2
Rotatable Bond2
Rings Closures5
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Symmetricatoms16
BasicNitrogens2
StereoCon

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