Responsive image

Common name

hex-2-yne

IUPAC name

hex-2-yne

SMILES

C(CC)C#CC

Common name

hex-2-yne

IUPAC name

hex-2-yne

SMILES

C(CC)C#CC

INCHI

InChI=1S/C6H10/c1-3-5-6-4-2/h3,5H2,1-2H3

FORMULA

C6H10

Responsive image

Common name

hex-2-yne

IUPAC name

hex-2-yne





Molecular weight

82.144

clogP

1.454

clogS

-1.432

Frequency

0.0003





HBond Acceptor

0

HBond Donor

0

Total Polar
Surface Area

0

Number of Rings

0

Rotatable Bond

2

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD00938 Iloprost Responsive image Platelet Aggregation Inhibitors; Vasodilator Agents; Antithrombotic Agents; Blood and Blood Forming Organs; Platelet Aggregation Inhibitors Excl. Heparin; Used for the treatment of pulmonary arterial hypertension.
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
3h0a_ligand_2_21.mol2 3h0a 0.7 -6.10 CC#CCC 5
4dq2_ligand_3_116.mol2 4dq2 0.7 -5.85 CCCC#C 5
2525 , 253