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C17H12NO4F | Cheminformatics
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(NZ)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-fluorochromen-4-ylidene]hydroxylamine

Molecular Formula : C17H12NO4F | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(NZ)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-fluorochromen-4-ylidene]hydroxylamine is a drug-like molecule.

MolName : (NZ)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-fluorochromen-4-ylidene]hydroxylamine

MolecularFormula : C17H12NO4F

Smiles : O/N=C1\c(cc(cc2)F)c2OC(c(cc2)cc3c2OCCO3)=C1

InChI : InChI=1S/C17H12FNO4/c18-11-2-4-14-12(8-11)13(19-20)9-16(23-14)10-1-3-15-17(7-10)22-6-5-21-15/h1-4,7-9,20H,5-6H2

InChIK : MWTSSSMHSQZXFU-UHFFFAOYSA-N

TotalMolweight : 313.283

Molweight : 313.283

MonoisotopicMass : 313.075037

CLogP : 4.0738

CLogS : -4.615

H Acceptors : 5

H Donors : 1

TotalSurfaceArea : 223.92

Relative PSA : 0.24388

PolarSurfaceArea : 60.28

Druglikeness : -8.9602

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.56522

Fragments : 1

Non HAtoms : 23

NonCHAtoms : 6

Electronegative Atoms : 6

Rotatable Bond : 1

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 6

StereoCon :

Click to Load Molecule:
1 - (NZ)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-fluorochromen-4-ylidene]hydroxylamine
2 - (NZ)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-fluorochromen-4-ylidene]hydroxylamine
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