COC(=O)C(CCCNC(=O)OC(C)(C)C)OP(=O)(O)C(NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C
Name: 2-{[1-(2-benzyloxycarbonylamino-3-phenyl-propionylamino)-2-methyl-propyl]-hydroxy-phosphinoyloxy}-5-tert-butoxycarbonylamino-pentanoic acid methyl ester
SMILES: COC(=O)C(CCCNC(=O)OC(C)(C)C)OP(=O)(O)C(NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C

Molecular Processing

Molecular formula
C32H46N3O10P
Molecular weight
663.71
Exact mass
663.2921
XLogP
4.67
TPSA
178.59
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
16
Heavy atoms
46
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
170.65

Supplementary Information

Details werden geladen…

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