N-[(Z)-[1-(3-phenoxypropyl)indol-3-yl]methylideneamino]pyridine-4-carboxamide

Formula:C24H22N4O2 Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[(Z)-[1-(3-phenoxypropyl)indol-3-yl]methylideneamino]pyridine-4-carboxamide is a drug-like molecule.

MolNameN-[(Z)-[1-(3-phenoxypropyl)indol-3-yl]methylideneamino]pyridine-4-carboxamide
MolecularFormulaC24H22N4O2
SmilesO=C(c1ccncc1)N/N=C\c1cn(CCCOc2ccccc2)c2c1cccc2
InChIInChI=1S/C24H22N4O2/c29-24(19-11-13-25-14-12-19)27-26-17-20-18-28(23-10-5-4-9-22(20)23)15-6-16-30-21-7-2-1-3-8-21/h1-5,7-14,17-18H,6,15-16H2,(H,27,29)
InChIKSYCBZOTYFYMFON-UHFFFAOYSA-N
TotalMolweight398.465
Molweight398.465
MonoisotopicMass398.174276
CLogP4.102
CLogS-4.339
H Acceptors6
H Donors1
TotalSurfaceArea320.59
Relative PSA0.19916
PolarSurfaceArea68.51
Druglikeness5.6881
Mutagenicnone
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.63333
Fragments1
Non HAtoms30
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms4
Symmetricatoms4
Aromatic Nitrogens2
StereoCon

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