AB47158
1953-02-2 | 2-(2-sulfanylpropanamido)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AB47158
ChemicalName
2-(2-sulfanylpropanamido)acetic acid
CasNumber
1953-02-2
MolecularFormula
C5H9NO3S
MolecularWeight
163.1949
MdlNumber
MFCD00004861
Smiles
CC(C(=O)NCC(=O)O)S
NscNumber
760416
Complexity
148
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
-0.1
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CatalogNumber: AB47158
ChemicalName: 2-(2-sulfanylpropanamido)acetic acid
CasNumber: 1953-02-2
MolecularFormula: C5H9NO3S
MolecularWeight: 163.1949
MdlNumber: MFCD00004861
Smiles: CC(C(=O)NCC(=O)O)S
NscNumber: 760416
Complexity: 148
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.1
CatalogNumber:
AB47158
ChemicalName:
2-(2-sulfanylpropanamido)acetic acid
CasNumber:
1953-02-2
MolecularFormula:
C5H9NO3S
MolecularWeight:
163.1949
MdlNumber:
MFCD00004861
Smiles:
CC(C(=O)NCC(=O)O)S
NscNumber:
760416
Complexity:
148
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCO[Ti](OCCCC)(OCCCC)OCCCC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCO[Ti](OCCCC)(OCCCC)OCCCC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB47162
ChemicalName: (1R,2R)-2-Aminocyclopentanol, HCl
CasNumber: 68327-11-7
MolecularFormula: C5H12ClNO
MolecularWeight: 137.6079
MdlNumber: MFCD09834692
Smiles: O[C@@H]1CCC[C@H]1N.Cl
NscNumber: __
Complexity: 65.1
Covalently-bondedUnitCount: 2
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB47162
ChemicalName:
(1R,2R)-2-Aminocyclopentanol, HCl
CasNumber:
68327-11-7
MolecularFormula:
C5H12ClNO
MolecularWeight:
137.6079
MdlNumber:
MFCD09834692
Smiles:
O[C@@H]1CCC[C@H]1N.Cl
NscNumber:
__
Complexity:
65.1
Covalently-bondedUnitCount:
2
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB47163
ChemicalName: (1S,2S)-2-Aminocyclopentanol, HCl
CasNumber: 68327-04-8
MolecularFormula: C5H12ClNO
MolecularWeight: 137.6079
MdlNumber: MFCD07370092
Smiles: O[C@H]1CCC[C@@H]1N.Cl
NscNumber: __
Complexity: 65.1
Covalently-bondedUnitCount: 2
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 3
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB47163
ChemicalName:
(1S,2S)-2-Aminocyclopentanol, HCl
CasNumber:
68327-04-8
MolecularFormula:
C5H12ClNO
MolecularWeight:
137.6079
MdlNumber:
MFCD07370092
Smiles:
O[C@H]1CCC[C@@H]1N.Cl
NscNumber:
__
Complexity:
65.1
Covalently-bondedUnitCount:
2
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
3
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__