C1CCC(CC1)CP(=O)(CC(CN)O)OCC2=CC=CC=C2.Cl
Name: (2R)-1-amino-3-[cyclohexylmethyl(phenylmethoxy)phosphoryl]propan-2-ol;hydrochloride
SMILES: C1CCC(CC1)CP(=O)(CC(CN)O)OCC2=CC=CC=C2.Cl

Molecular Processing

Molecular formula
C17H29ClNO3P
Molecular weight
361.85
Exact mass
361.1574
XLogP
3.8
TPSA
72.55
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.647
Molar refractivity
97.46

Supplementary Information

InChIKey: ISRGMCDVXFDUKH-UNJGFRQOSA-N
Synonyme
SCHEMBL3384169ISRGMCDVXFDUKH-UNJGFRQOSA-N((r)-3-amino-2-hydroxy-propyl)-cyclohexylmethyl phosphinic acid benzyl ester hydrochloride((R)-3-amino-2-hydroxy-propyl)-cyclohexylmethyl-phosphinic acid benzyl ester hydrochloride
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