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MolName : 4-[(2Z)-2-[(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl)methylidene]hydrazinyl]benzoic acid

MolecularFormula : C19H14N3O4Cl

Smiles : OC(c(cc1)ccc1N/N=C\c(c(Cl)nc1c2)cc1cc1c2OCCO1)=O

InChI : InChI=1S/C19H14ClN3O4/c20-18-13(10-21-23-14-3-1-11(2-4-14)19(24)25)7-12-8-16-17(9-15(12)22-18)27-6-5-26-16/h1-4,7-10,23H,5-6H2,(H,24,25)

InChIK : BIZGKIVEVRIRNO-UHFFFAOYSA-N

TotalMolweight : 383.79

Molweight : 383.79

MonoisotopicMass : 383.067284

CLogP : 5.3242

CLogS : -4.549

H Acceptors : 7

H Donors : 2

TotalSurfaceArea : 276.14

Relative PSA : 0.29

PolarSurfaceArea : 93.04

Druglikeness : -5.276

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : imine/hydrazone of aldehyde

Shape Index : 0.62963

Fragments : 1

Non HAtoms : 27

NonCHAtoms : 8

Electronegative Atoms : 8

Rotatable Bond : 4

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 16

Sp3Atoms : 5

Symmetricatoms : 2

Aromatic Nitrogens : 1

AcidicOxygens : 1

StereoCon :