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[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3S,5S)-3-hydroxy-5-[(2-phenoxyacetyl)amino]-1,6-diphenylhexan-2-yl]carbamate

Formula:C33H38N2O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3S,5S)-3-hydroxy-5-[(2-phenoxyacetyl)amino]-1,6-diphenylhexan-2-yl]carbamate is not a drug-like molecule.
MolName[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3S,5S)-3-hydroxy-5-[(2-phenoxyacetyl)amino]-1,6-diphenylhexan-2-yl]carbamate
MolecularFormulaC33H38N2O7
SmilesO[C@@H](C[C@H](Cc1ccccc1)NC(COc1ccccc1)=O)[C@H](Cc1ccccc1)NC(O[C@@H]1[C@H](CCO2)[C@H]2OC1)=O
InChIInChI=1S/C33H38N2O7/c36-29(20-25(18-23-10-4-1-5-11-23)34-31(37)22-40-26-14-8-3-9-15-26)28(19-24-12-6-2-7-13-24)35-33(38)42-30-21-41-32-27(30)16-17-39-32/h1-15,25,27-30,32,36H,16-22H2,(H,34,37)(H,35,38)/t25-,27-,28-,29-,30-,32-/m0/s1
InChIKPUZGZFDZPYTBGL-KZECFEFESA-N
TotalMolweight574.672
Molweight574.672
MonoisotopicMass574.267903
CLogP3.886
CLogS-5.583
H Acceptors9
H Donors3
TotalSurfaceArea441.87
Relative PSA0.23106
PolarSurfaceArea115.35
Druglikeness-11.539
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.45238
Fragments1
Non HAtoms42
NonCHAtoms9
Electronegative Atoms9
StereoCenters6
Rotatable Bond14
Rings Closures5
Small Rings5
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms18
Symmetricatoms6
Amides2
StereoConthis enantiomer

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