CC1(CC(CC(C1)(C)C)C2=CC=CC=C2N3CCN(CC3)CC4CC4CO)C
الاسم: [(1R,2R)-2-[[4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazin-1-yl]methyl]cyclopropyl]methanol
SMILES: CC1(CC(CC(C1)(C)C)C2=CC=CC=C2N3CCN(CC3)CC4CC4CO)C

Molecular Processing

Molecular formula
C25H40N2O
Molecular weight
384.61
Exact mass
384.3141
XLogP
4.76
TPSA
26.71
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.76
Molar refractivity
117.93

Supplementary Information

InChIKey: YHLZXCCQWQYOFC-PMACEKPBSA-N
مرادفات
SCHEMBL4856425YHLZXCCQWQYOFC-PMACEKPBSA-Ntrans-(2-{4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazin-1-ylmethyl}cyclopropyl)methanol
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