AI06191
10389-65-8 | (Boc-Cys-OH)2
Manufacturer: A2B Chem
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CatalogNumber
AI06191
ChemicalName
(Boc-Cys-OH)2
CasNumber
10389-65-8
MolecularFormula
C16H28N2O8S2
MolecularWeight
440.5321
MdlNumber
MFCD00038250
Smiles
OC(=O)[C@@H](NC(=O)OC(C)(C)C)CSSC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity
522
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
28
HydrogenBondAcceptorCount
10
HydrogenBondDonorCount
4
RotatableBondCount
13
Xlogp3
1.6
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CatalogNumber: AI06191
ChemicalName: (Boc-Cys-OH)2
CasNumber: 10389-65-8
MolecularFormula: C16H28N2O8S2
MolecularWeight: 440.5321
MdlNumber: MFCD00038250
Smiles: OC(=O)[C@@H](NC(=O)OC(C)(C)C)CSSC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 522
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 10
HydrogenBondDonorCount: 4
RotatableBondCount: 13
Xlogp3: 1.6
CatalogNumber:
AI06191
ChemicalName:
(Boc-Cys-OH)2
CasNumber:
10389-65-8
MolecularFormula:
C16H28N2O8S2
MolecularWeight:
440.5321
MdlNumber:
MFCD00038250
Smiles:
OC(=O)[C@@H](NC(=O)OC(C)(C)C)CSSC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
522
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
10
HydrogenBondDonorCount:
4
RotatableBondCount:
13
Xlogp3:
1.6
CatalogNumber: AI06192
ChemicalName: Lacidipine
CasNumber: 103890-78-4
MolecularFormula: C26H33NO6
MolecularWeight: 455.5433
MdlNumber: MFCD00865936
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1/C=C/C(=O)OC(C)(C)C)C(=O)OCC)C
Complexity: 805
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 33
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 11
Xlogp3: 4.5
CatalogNumber:
AI06192
ChemicalName:
Lacidipine
CasNumber:
103890-78-4
MolecularFormula:
C26H33NO6
MolecularWeight:
455.5433
MdlNumber:
MFCD00865936
Smiles:
CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1/C=C/C(=O)OC(C)(C)C)C(=O)OCC)C
Complexity:
805
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
11
Xlogp3:
4.5
CatalogNumber: AI06193
ChemicalName: (R)-5-Bromo-2,3-dihydro-1h-inden-1-ol
CasNumber: 1038919-63-9
MolecularFormula: C9H9BrO
MolecularWeight: 213.0712
MdlNumber: MFCD15529783
Smiles: Brc1ccc2c(c1)CC[C@H]2O
Complexity: 149
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
AI06193
ChemicalName:
(R)-5-Bromo-2,3-dihydro-1h-inden-1-ol
CasNumber:
1038919-63-9
MolecularFormula:
C9H9BrO
MolecularWeight:
213.0712
MdlNumber:
MFCD15529783
Smiles:
Brc1ccc2c(c1)CC[C@H]2O
Complexity:
149
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC(=O)Nc1ccc(cc1Cl)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC(=O)Nc1ccc(cc1Cl)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__