AF84879
328023-11-6 | Rbin-1
Manufacturer: A2B Chem
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CatalogNumber
AF84879
ChemicalName
Rbin-1
CasNumber
328023-11-6
MolecularFormula
C13H12N4S
MolecularWeight
256.3262
MdlNumber
MFCD02369534
Smiles
CC(=C)CSc1nnc2c(n1)[nH]c1c2cccc1
Complexity
322
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3.2
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CatalogNumber: AF84879
ChemicalName: Rbin-1
CasNumber: 328023-11-6
MolecularFormula: C13H12N4S
MolecularWeight: 256.3262
MdlNumber: MFCD02369534
Smiles: CC(=C)CSc1nnc2c(n1)[nH]c1c2cccc1
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AF84879
ChemicalName:
Rbin-1
CasNumber:
328023-11-6
MolecularFormula:
C13H12N4S
MolecularWeight:
256.3262
MdlNumber:
MFCD02369534
Smiles:
CC(=C)CSc1nnc2c(n1)[nH]c1c2cccc1
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccc(c1)c1cccc(c1O)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc(c1)c1cccc(c1O)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF84882
ChemicalName: (R)-2-((4-Aminophenethyl)amino)-1-phenylethanol
CasNumber: 391901-45-4
MolecularFormula: C16H20N2O
MolecularWeight: 256.3428
MdlNumber: MFCD28125625
Smiles: Nc1ccc(cc1)CCNC[C@@H](c1ccccc1)O
Complexity: 233
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 6
Xlogp3: 1.9
CatalogNumber:
AF84882
ChemicalName:
(R)-2-((4-Aminophenethyl)amino)-1-phenylethanol
CasNumber:
391901-45-4
MolecularFormula:
C16H20N2O
MolecularWeight:
256.3428
MdlNumber:
MFCD28125625
Smiles:
Nc1ccc(cc1)CCNC[C@@H](c1ccccc1)O
Complexity:
233
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
6
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1ccc(cn1c1ccccc1)c1ccccn1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1ccc(cn1c1ccccc1)c1ccccn1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__