Responsive image

Common name

(R)-hexan-2-ol

IUPAC name

(R)-hexan-2-ol

SMILES

C(C)CC[C@@H](C)O

Common name

(R)-hexan-2-ol

IUPAC name

(R)-hexan-2-ol

SMILES

C(C)CC[C@@H](C)O

INCHI

InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3/t6-/m1/s1

FORMULA

C6H14O

Responsive image

Common name

(R)-hexan-2-ol

IUPAC name

(R)-hexan-2-ol





Molecular weight

102.175

clogP

1.107

clogS

-1.267

Frequency

0.0003





HBond Acceptor

1

HBond Donor

1

Total Polar
Surface Area

20.23

Number of Rings

0

Rotatable Bond

3

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD02967 aureofungin Responsive image Fungicide Fungicide
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
2p4j_ligand_4_1334.mol2 2p4j 1 -6.77 C(C(C)C)C[C@H](C)O 8
2g94_ligand_4_2730.mol2 2g94 1 -6.64 C(C)(C)CC[C@H](C)O 8
3dzt_ligand_5_1716.mol2 3dzt 1 -6.57 CCCC[C@@H](O)C 7
2z7g_ligand_4_20.mol2 2z7g 1 -6.45 C(CC)C[C@@H](O)C 7
1xs7_ligand_4_671.mol2 1xs7 1 -6.44 C(CC(C)C)[C@@H](O)C 8
1gnm_ligand_4_1041.mol2 1gnm 1 -6.30 C(C)(C)CC[C@H](O)C 8
216 , 22