Responsive image

Common name

(R)-phenyl(pyrimidin-5-yl)methanol

IUPAC name

(R)-phenyl(pyrimidin-5-yl)methanol

SMILES

c1(cncnc1)[C@@H](c1ccccc1)O

Common name

(R)-phenyl(pyrimidin-5-yl)methanol

IUPAC name

(R)-phenyl(pyrimidin-5-yl)methanol

SMILES

c1(cncnc1)[C@@H](c1ccccc1)O

INCHI

InChI=1S/C11H10N2O/c14-11(9-4-2-1-3-5-9)10-6-12-8-13-7-10/h1-8,11,14H/t11-/m1/s1

FORMULA

C11H10N2O

Responsive image

Common name

(R)-phenyl(pyrimidin-5-yl)methanol

IUPAC name

(R)-phenyl(pyrimidin-5-yl)methanol





Molecular weight

186.210

clogP

2.022

clogS

-2.433

Frequency

0.0003





HBond Acceptor

3

HBond Donor

1

Total Polar
Surface Area

46.01

Number of Rings

2

Rotatable Bond

2

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD03203 triarimol Responsive image Fungicide Fungicide
1 , 1
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
3mvh_ligand_1_0.mol2 3mvh 0.537313 -7.00 CCc1c[nH+]c2[nH]cncc12 11
3eb1_ligand_3_3.mol2 3eb1 0.537037 -6.30 C[C@@H](O)c1cccc(N)c1 10
4b05_ligand_1_2.mol2 4b05 0.516667 -6.99 c1(cncnc1)c1ccccc1 12
4b77_ligand_1_3.mol2 4b77 0.516667 -6.97 c1cc(ccc1)c1cncnc1 12
4b72_ligand_1_3.mol2 4b72 0.516667 -6.91 c1(cncnc1)c1ccccc1 12
4l7g_ligand_1_1.mol2 4l7g 0.516667 -6.87 c1(cncnc1)c1ccccc1 12
102 , 11