N-[(Z)-(3-hydroxyphenyl)methylideneamino]-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanamide

Formula:C22H23N3O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(3-hydroxyphenyl)methylideneamino]-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanamide is a drug-like molecule.

MolNameN-[(Z)-(3-hydroxyphenyl)methylideneamino]-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanamide
MolecularFormulaC22H23N3O2
SmilesOc1cccc(/C=N\NC(CCn2c(cccc3)c3c3c2CCCC3)=O)c1
InChIInChI=1S/C22H23N3O2/c26-17-7-5-6-16(14-17)15-23-24-22(27)12-13-25-20-10-3-1-8-18(20)19-9-2-4-11-21(19)25/h1,3,5-8,10,14-15,26H,2,4,9,11-13H2,(H,24,27)
InChIKZYOLWHDNJSQQFR-UHFFFAOYSA-N
TotalMolweight361.444
Molweight361.444
MonoisotopicMass361.179027
CLogP4.1879
CLogS-4.466
H Acceptors5
H Donors2
TotalSurfaceArea286.2
Relative PSA0.1956
PolarSurfaceArea66.62
Druglikeness1.3617
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.55556
Fragments1
Non HAtoms27
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms15
Sp3Atoms7
Aromatic Nitrogens1
StereoCon

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