[(11Z)-12-(hydroxymethyl)-1,2,3,4,5,6,7,8,9,10-decaboracyclododec-11-en-11-yl]methanol

Formula:C4H16O2B10 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(11Z)-12-(hydroxymethyl)-1,2,3,4,5,6,7,8,9,10-decaboracyclododec-11-en-11-yl]methanol is a drug-like molecule.

MolName[(11Z)-12-(hydroxymethyl)-1,2,3,4,5,6,7,8,9,10-decaboracyclododec-11-en-11-yl]methanol
MolecularFormulaC4H16O2B10
SmilesOC/C(/BBBBBBBBBB1)=C1\CO
InChIInChI=1S/C4H16B10O2/c15-1-3-4(2-16)6-8-10-12-14-13-11-9-7-5-3/h5-16H,1-2H2
InChIKYGUNXKSLVBUUFS-UHFFFAOYSA-N
TotalMolweight204.279
Molweight204.279
MonoisotopicMass206.20808
CLogP-0.8762
CLogS0.03
H Acceptors2
H Donors2
TotalSurfaceArea63.14
Relative PSA0.41495
PolarSurfaceArea40.46
Druglikeness-7.9712
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsunwanted atom
Shape Index0.5625
Fragments1
Non HAtoms16
NonCHAtoms12
Electronegative Atoms2
Rotatable Bond2
Rings Closures1
Sp3Atoms4
Symmetricatoms8
StereoCon

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