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Structure - PowerPoint PPT Presentation


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Structure. ID. SMDL.ID. SMDL.IDX. SMDL.SID. 470. 470. SMDL-00000470. 23. 471. 471. SMDL-00000471. 23. 472. 472. SMDL-00000472. 23. 473. 473. SMDL-00000473. 23. Property. Value. ID. 470. SMDL.ID. 470. SMDL.IDX. SMDL-00000470. SMDL.SID. 23. MOL.REF.

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Presentation Transcript
slide1

Structure

ID

SMDL.ID

SMDL.IDX

SMDL.SID

470

470

SMDL-00000470

23

471

471

SMDL-00000471

23

472

472

SMDL-00000472

23

473

473

SMDL-00000473

23

slide2

Property

Value

ID

470

SMDL.ID

470

SMDL.IDX

SMDL-00000470

SMDL.SID

23

MOL.REF

Bioorg. Med. Chem. Lett. 12(2)-2002 243-248

MOL.NAME

1

MOL.GNAME

R-95292

MOL.SMI

CN(C)CC1CC2N(O1)c3cc(Cl)ccc3Oc4ccccc24

EST.LOGKOW

4.98

EST.LOGWSOL

-5.967

slide3

Property

Value

ID

471

SMDL.ID

471

SMDL.IDX

SMDL-00000471

SMDL.SID

23

MOL.REF

Bioorg. Med. Chem. Lett. 12(2)-2002 243-248

MOL.NAME

3

MOL.GNAME

mianserin

MOL.SMI

CN1CCN2C(C1)c3ccccc3Cc4ccccc24

EST.LOGKOW

3.35

EST.LOGWSOL

-4.09

slide4

Property

Value

ID

472

SMDL.ID

472

SMDL.IDX

SMDL-00000472

SMDL.SID

23

MOL.REF

Bioorg. Med. Chem. Lett. 12(2)-2002 243-248

MOL.NAME

2a

MOL.GNAME

MOL.SMI

CN(C)CC1CC2N(O1)c3ccccc3Cc4ccccc24

EST.LOGKOW

4.3

EST.LOGWSOL

-5.122

slide5

Property

Value

ID

473

SMDL.ID

473

SMDL.IDX

SMDL-00000473

SMDL.SID

23

MOL.REF

Bioorg. Med. Chem. Lett. 12(2)-2002 243-248

MOL.NAME

2b

MOL.GNAME

MOL.SMI

CN(C)CCC1CC2N(O1)c3ccccc3Cc4ccccc24

EST.LOGKOW

4.79

EST.LOGWSOL

-5.644

slide6

C1=CC=CC=C1

naphthalene

42