AB05418
204452-91-5 | 7-Dimethoxymethyl-1,2,3,4-tetrahydro-[1,8]naphthyridine
Manufacturer: A2B Chem
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CatalogNumber
AB05418
ChemicalName
7-Dimethoxymethyl-1,2,3,4-tetrahydro-[1,8]naphthyridine
CasNumber
204452-91-5
MolecularFormula
C11H16N2O2
MolecularWeight
208.2569
MdlNumber
MFCD06657573
Smiles
COC(c1ccc2c(n1)NCCC2)OC
Complexity
197
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AB05418
ChemicalName: 7-Dimethoxymethyl-1,2,3,4-tetrahydro-[1,8]naphthyridine
CasNumber: 204452-91-5
MolecularFormula: C11H16N2O2
MolecularWeight: 208.2569
MdlNumber: MFCD06657573
Smiles: COC(c1ccc2c(n1)NCCC2)OC
Complexity: 197
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB05418
ChemicalName:
7-Dimethoxymethyl-1,2,3,4-tetrahydro-[1,8]naphthyridine
CasNumber:
204452-91-5
MolecularFormula:
C11H16N2O2
MolecularWeight:
208.2569
MdlNumber:
MFCD06657573
Smiles:
COC(c1ccc2c(n1)NCCC2)OC
Complexity:
197
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
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Smiles: COC(c1ccc2c(n1)nccc2)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COC(c1ccc2c(n1)nccc2)OC
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RotatableBondCount:
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Smiles: O=C(N1CCN(C1=O)C(=O)OC(C)(C)C)OC(C)(C)C
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Smiles:
O=C(N1CCN(C1=O)C(=O)OC(C)(C)C)OC(C)(C)C
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Smiles: NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cc1ccc(cc1)O)CO)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)N)CCCCN)CC(=O)O
Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cc1ccc(cc1)O)CO)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)N)CCCCN)CC(=O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__