AD33635
18668-08-1 | H-Pro-Gln-OH
Manufacturer: A2B Chem
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CatalogNumber
AD33635
ChemicalName
H-Pro-Gln-OH
CasNumber
18668-08-1
MolecularFormula
C10H17N3O4
MolecularWeight
243.2597
MdlNumber
MFCD00037873
Smiles
NC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1
Complexity
319
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
4
RotatableBondCount
6
Xlogp3
-4.9
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CatalogNumber: AD33635
ChemicalName: H-Pro-Gln-OH
CasNumber: 18668-08-1
MolecularFormula: C10H17N3O4
MolecularWeight: 243.2597
MdlNumber: MFCD00037873
Smiles: NC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1
Complexity: 319
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 4
RotatableBondCount: 6
Xlogp3: -4.9
CatalogNumber:
AD33635
ChemicalName:
H-Pro-Gln-OH
CasNumber:
18668-08-1
MolecularFormula:
C10H17N3O4
MolecularWeight:
243.2597
MdlNumber:
MFCD00037873
Smiles:
NC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1
Complexity:
319
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
4
RotatableBondCount:
6
Xlogp3:
-4.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(N[SiH2]NC(C)(C)C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(N[SiH2]NC(C)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD33643
ChemicalName: 2-Fluoro-5-iodophenol
CasNumber: 186589-89-9
MolecularFormula: C6H4FIO
MolecularWeight: 237.9982
MdlNumber: MFCD16659616
Smiles: Ic1ccc(c(c1)O)F
Complexity: 99.1
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
AD33643
ChemicalName:
2-Fluoro-5-iodophenol
CasNumber:
186589-89-9
MolecularFormula:
C6H4FIO
MolecularWeight:
237.9982
MdlNumber:
MFCD16659616
Smiles:
Ic1ccc(c(c1)O)F
Complexity:
99.1
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(C)ccc1I
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(C)ccc1I
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__