AA47713

132679-61-9 | Fdnp-val-nh2

Manufacturer: A2B Chem

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CatalogNumber

AA47713

ChemicalName

Fdnp-val-nh2

CasNumber

132679-61-9

MolecularFormula

C11H13FN4O5

MolecularWeight

300.2431231999999

MdlNumber

MFCD00155636

Smiles

CC([C@@H](C(=O)N)Nc1cc(F)c(cc1[N+](=O)[O-])[N+](=O)[O-])C

Complexity

422

Covalently-bondedUnitCount

1

DefinedAtomStereocenterCount

1

HeavyAtomCount

21

HydrogenBondAcceptorCount

7

HydrogenBondDonorCount

2

RotatableBondCount

4

Xlogp3

2.5

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Show Difference

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A2B Chem

AA47713

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CatalogNumber:
AA47713

ChemicalName:
Fdnp-val-nh2

CasNumber:
132679-61-9

MolecularFormula:
C11H13FN4O5

MolecularWeight:
300.2431231999999

MdlNumber:
MFCD00155636

Smiles:
CC([C@@H](C(=O)N)Nc1cc(F)c(cc1[N+](=O)[O-])[N+](=O)[O-])C

Complexity:
422

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
1

HeavyAtomCount:
21

HydrogenBondAcceptorCount:
7

HydrogenBondDonorCount:
2

RotatableBondCount:
4

Xlogp3:
2.5

Img

A2B Chem

AA47714

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
ClCCC(=O)Nc1ccc(c(c1)F)F

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA47716

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
O=c1[nH]c2c(o1)cc(c(c2)F)N

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA47720

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CatalogNumber:
AA47720

ChemicalName:
2-(Aminomethyl)-5-methylpyrazine

CasNumber:
132664-85-8

MolecularFormula:
C6H9N3

MolecularWeight:
123.1558

MdlNumber:
MFCD01314542

Smiles:
Cc1cnc(cn1)CN

Complexity:
84.4

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
9

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
1

RotatableBondCount:
1

Xlogp3:
-0.9