AC13997
869288-64-2 | PF-573228
Manufacturer: A2B Chem
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CatalogNumber
AC13997
ChemicalName
PF-573228
CasNumber
869288-64-2
MolecularFormula
C22H20F3N5O3S
MolecularWeight
491.4861
MdlNumber
MFCD11519967
Smiles
O=C1CCc2c(N1)ccc(c2)Nc1ncc(c(n1)NCc1cccc(c1)S(=O)(=O)C)C(F)(F)F
Complexity
822
Covalently-bondedUnitCount
1
HeavyAtomCount
34
HydrogenBondAcceptorCount
10
HydrogenBondDonorCount
3
RotatableBondCount
6
Xlogp3
3.2
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CatalogNumber: AC13997
ChemicalName: PF-573228
CasNumber: 869288-64-2
MolecularFormula: C22H20F3N5O3S
MolecularWeight: 491.4861
MdlNumber: MFCD11519967
Smiles: O=C1CCc2c(N1)ccc(c2)Nc1ncc(c(n1)NCc1cccc(c1)S(=O)(=O)C)C(F)(F)F
Complexity: 822
Covalently-bondedUnitCount: 1
HeavyAtomCount: 34
HydrogenBondAcceptorCount: 10
HydrogenBondDonorCount: 3
RotatableBondCount: 6
Xlogp3: 3.2
CatalogNumber:
AC13997
ChemicalName:
PF-573228
CasNumber:
869288-64-2
MolecularFormula:
C22H20F3N5O3S
MolecularWeight:
491.4861
MdlNumber:
MFCD11519967
Smiles:
O=C1CCc2c(N1)ccc(c2)Nc1ncc(c(n1)NCc1cccc(c1)S(=O)(=O)C)C(F)(F)F
Complexity:
822
Covalently-bondedUnitCount:
1
HeavyAtomCount:
34
HydrogenBondAcceptorCount:
10
HydrogenBondDonorCount:
3
RotatableBondCount:
6
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CS(=O)c1c[nH]c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CS(=O)c1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CCC(C1)c1ccc(cc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCC(C1)c1ccc(cc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AC14007
ChemicalName: Glycyl-L-leucine
CasNumber: 869-19-2
MolecularFormula: C8H16N2O3
MolecularWeight: 188.2242
MdlNumber: MFCD00008127
Smiles: NCC(=O)N[C@H](C(=O)O)CC(C)C
Complexity: 192
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 5
Xlogp3: -2.3
CatalogNumber:
AC14007
ChemicalName:
Glycyl-L-leucine
CasNumber:
869-19-2
MolecularFormula:
C8H16N2O3
MolecularWeight:
188.2242
MdlNumber:
MFCD00008127
Smiles:
NCC(=O)N[C@H](C(=O)O)CC(C)C
Complexity:
192
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
5
Xlogp3:
-2.3