AE28674
1028327-66-3 | VUF 10460
Manufacturer: A2B Chem
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CatalogNumber
AE28674
ChemicalName
VUF 10460
CasNumber
1028327-66-3
MolecularFormula
C15H19N5
MolecularWeight
269.3449
MdlNumber
MFCD00055218
Smiles
CN1CCN(CC1)c1nc(N)nc(c1)c1ccccc1
Complexity
297
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AE28674
ChemicalName: VUF 10460
CasNumber: 1028327-66-3
MolecularFormula: C15H19N5
MolecularWeight: 269.3449
MdlNumber: MFCD00055218
Smiles: CN1CCN(CC1)c1nc(N)nc(c1)c1ccccc1
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AE28674
ChemicalName:
VUF 10460
CasNumber:
1028327-66-3
MolecularFormula:
C15H19N5
MolecularWeight:
269.3449
MdlNumber:
MFCD00055218
Smiles:
CN1CCN(CC1)c1nc(N)nc(c1)c1ccccc1
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: AE28676
ChemicalName: (2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CasNumber: 1009335-39-0
MolecularFormula: C13H17NO4
MolecularWeight: 251.2784
MdlNumber: MFCD18837818
Smiles: OC[C@H]1C[C@H](CN1C(=O)OCc1ccccc1)O
Complexity: 278
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 0.5
CatalogNumber:
AE28676
ChemicalName:
(2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
CasNumber:
1009335-39-0
MolecularFormula:
C13H17NO4
MolecularWeight:
251.2784
MdlNumber:
MFCD18837818
Smiles:
OC[C@H]1C[C@H](CN1C(=O)OCc1ccccc1)O
Complexity:
278
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
0.5
CatalogNumber: __
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Smiles: C1C[NH+]2CCN1CC2.OC[C@H](Oc1cc(Oc2ccc(nc2)S(=O)(=O)CC)cc(c1)C(=O)[O-])C
Complexity: __
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Smiles:
C1C[NH+]2CCN1CC2.OC[C@H](Oc1cc(Oc2ccc(nc2)S(=O)(=O)CC)cc(c1)C(=O)[O-])C
Complexity:
__
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RotatableBondCount:
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Xlogp3:
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Smiles: Clc1nc(nc2c1cccc2)C12CC3CC(C2)CC(C1)C3
Complexity: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Clc1nc(nc2c1cccc2)C12CC3CC(C2)CC(C1)C3
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__