UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

4574768
4574768
4574765
4574765

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Popular Name: Boc-ala-d-glu(obzl)-nh2 Boc-ala-d-glu(obzl)-nh2

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.34 4.11 -18.49 4 9 0 137 407.467 12 ↓

Analogs

6493395
6493395

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Popular Name: Boc-his(3-bom)-ome hcl Boc-his(3-bom)-ome hcl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.45 8.82 -15.61 1 8 0 92 389.452 11 ↓
Mid Mid (pH 6-8) 4.45 9.33 -42.57 2 8 1 93 390.46 11 ↓

Analogs

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Popular Name: (2S)-5-amino-2-(tert-butoxycarbonylamino)-5-keto-valeric-acid-succinimido-ester (2S)-5-amino-2-(tert-butoxycarbo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.10 2.51 -20.98 3 10 0 145 343.336 9 ↓

Analogs

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Popular Name: Boc-his-ome Boc-his-ome

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.81 4.49 -14.32 2 7 0 93 269.301 7 ↓
Ref Reference (pH 7) 2.81 4.96 -45.16 3 7 1 95 270.309 7 ↓
Mid Mid (pH 6-8) 2.81 4.45 -14.18 2 7 0 93 269.301 7 ↓

Analogs

39271059
39271059
39271060
39271060
39271061
39271061
39271062
39271062

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Popular Name: N-Boc-trans-4-Hydroxy-L-proline methyl ester N-Boc-trans-4-Hydroxy-L-proline …

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.71 2.31 -13.29 1 6 0 76 245.275 4 ↓

Analogs

34655907
34655907

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Popular Name: Boc-Ser-OBzl Boc-Ser-OBzl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.74 -1.68 -8.09 2 6 0 84 295.335 8 ↓

Analogs

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Popular Name: (2S)-2-(tert-butoxycarbonylamino)-3-(1H-indol-3-yl)propionic-acid-succinimido-ester (2S)-2-(tert-butoxycarbonylamino…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.79 8.57 -24.46 2 9 0 118 401.419 8 ↓

Analogs

34574914
34574914

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Popular Name: Boc-Tyr-OMe Boc-Tyr-OMe

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.11 -0.12 -12.25 2 6 0 84 295.335 7 ↓

Analogs

34574914
34574914

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Popular Name: BOC-D-TYR-OME BOC-D-TYR-OME

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.11 -0.12 -12.22 2 6 0 84 295.335 7 ↓

Analogs

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Popular Name: Boc-phe-obz Boc-phe-obz

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.18 9.99 -6.14 1 5 0 65 355.434 9 ↓

Analogs

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Popular Name: Boc-Ser-Otbu Boc-Ser-Otbu

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.34 1.71 -6.97 2 6 0 85 261.318 7 ↓

Analogs

39271059
39271059
39271060
39271060
39271061
39271061
39271062
39271062

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Popular Name: N-Boc-cis-4-hydroxy-L-proline methyl ester N-Boc-cis-4-hydroxy-L-proline me…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.71 2.31 -12.86 1 6 0 76 245.275 4 ↓

Analogs

38272427
38272427
44240449
44240449
44240452
44240452

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Popular Name: N-Boc-L-leucinol N-Boc-L-leucinol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.94 -1.7 -5.34 2 4 0 58 217.309 6 ↓

Analogs

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Popular Name: (S)-tert-Butyl (5-amino-1-hydroxy-5-oxopentan-2-yl)carbamate (S)-tert-Butyl (5-amino-1-hydrox…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.56 -2.59 -10.79 4 6 0 102 232.28 7 ↓

Analogs

44123171
44123171

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Popular Name: Boc-tyr-obzl Boc-tyr-obzl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.70 -0.6 -11.71 2 6 0 84 371.433 9 ↓

Analogs

34459868
34459868
38778439
38778439
38778440
38778440

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Popular Name: N-Boc-D-phenylalaninol N-Boc-D-phenylalaninol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.09 -1.97 -6.98 2 4 0 58 251.326 6 ↓

Analogs

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Popular Name: Ethyl N-(Boc-aminoethyl)glycinate hydrochloride Ethyl N-(Boc-aminoethyl)glycinat…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.81 1.78 -10.28 2 6 0 77 246.307 9 ↓

Analogs

33945239
33945239
33945240
33945240
34427507
34427507
34427508
34427508
38284436
38284436

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Popular Name: Boc-Ser-OMe Boc-Ser-OMe

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.15 -1.8 -7.83 2 6 0 84 219.237 6 ↓

Analogs

34459868
34459868
38778439
38778439
38778440
38778440

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Popular Name: N-Boc-DL-Phenylalaninol N-Boc-DL-Phenylalaninol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.09 3.58 -6.89 2 4 0 59 251.326 6 ↓

Analogs

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Popular Name: L-Boc-phenyl-alanine methyl ester L-Boc-phenyl-alanine methyl ester

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.59 7.05 -10.91 1 5 0 65 279.336 7 ↓

Analogs

34597507
34597507

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Popular Name: Boc-Phe-ol Boc-Phe-ol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.03 3.78 -5.17 2 4 0 59 257.374 6 ↓

Analogs

32008227
32008227
32008229
32008229
34562422
34562422
44240372
44240372
44240375
44240375

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Popular Name: Boc-L-Alaninol Boc-L-Alaninol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.63 -2.65 -6.43 2 4 0 58 175.228 4 ↓

Analogs

39271059
39271059
39271060
39271060
39271061
39271061
39271062
39271062

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Popular Name: BOC-HYP-OTBU BOC-HYP-OTBU

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.90 -0.12 -12.35 1 6 0 76 287.356 5 ↓

Analogs

2583095
2583095
2583100
2583100
2583102
2583102
4321887
4321887

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Popular Name: BOC-TRP-OME BOC-TRP-OME

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.74 0.89 -12.4 2 6 0 80 318.373 7 ↓

Analogs

36202650
36202650

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Popular Name: Boc-Hyp-OBzl Boc-Hyp-OBzl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.31 6.27 -13.64 1 6 0 76 321.373 6 ↓

Analogs

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Popular Name: (1-Methyl-2-oxoethyl)carbamic acid tert-butyl ester (1-Methyl-2-oxoethyl)carbamic ac…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
CATK-2-E Cathepsin K (cluster #2 Of 3), Eukaryotic Eukaryotes 200 0.78 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
CATK_HUMAN P43235 Cathepsin K, Human 200 0.78 Binding ≤ 1μM
CATK_HUMAN P43235 Cathepsin K, Human 200 0.78 Binding ≤ 10μM

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.08 0.05 -9.79 1 4 0 55 173.212 4 ↓

Analogs

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Popular Name: Methyl 2-((tert-butoxycarbonyl)amino)-3-iodopropanoate Methyl 2-((tert-butoxycarbonyl)a…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.79 -0.07 -5.3 1 5 0 64 329.134 6 ↓

Analogs

44240760
44240760

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Popular Name: Boc-Glycine methyl ester Boc-Glycine methyl ester

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.00 2.05 -6.13 1 5 0 65 189.211 5 ↓

Analogs

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Popular Name: (2,3,4,5,6-pentafluorophenyl) (2,3,4,5,6-pentafluorophenyl)

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.79 11.88 -8.68 1 5 0 65 463.358 7 ↓

Analogs

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Popular Name: (2,3,4,5,6-pentafluorophenyl) (2,3,4,5,6-pentafluorophenyl)

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 8.42 14.81 -7.46 1 5 0 65 519.466 10 ↓

Analogs

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Popular Name: (2,3,4,5,6-pentafluorophenyl) (2,3,4,5,6-pentafluorophenyl)

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 8.11 14.72 -8.83 1 6 0 74 563.519 10 ↓

Analogs

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Popular Name: (2,3,4,5,6-pentafluorophenyl) (2,3,4,5,6-pentafluorophenyl)

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.04 14.8 -13.28 0 5 0 56 477.385 7 ↓

Analogs

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Popular Name: (2,3,4,5,6-pentafluorophenyl) (2,3,4,5,6-pentafluorophenyl)

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 8.53 18.24 -12.5 1 5 0 65 599.577 11 ↓

Analogs

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Popular Name: (2,3,4,5,6-pentafluorophenyl) (2,3,4,5,6-pentafluorophenyl)

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 7.94 14.42 -16.26 2 8 0 103 620.571 13 ↓

Analogs

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Popular Name: (S)-Methyl 2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-hydroxypropanoate (S)-Methyl 2-((((9H-fluoren-9-yl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.31 5.64 -10.66 2 6 0 85 341.363 7 ↓

Analogs

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Popular Name: N-Fmoc-L-threonol N-Fmoc-L-threonol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.18 -3.73 -10.13 3 5 0 78 327.38 6 ↓

Analogs

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Popular Name: N-Fmoc-L-threonol N-Fmoc-L-threonol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.18 -4.9 -9.95 3 5 0 78 327.38 6 ↓

Analogs

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Popular Name: N-Fmoc-L-threonol N-Fmoc-L-threonol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.18 -4.88 -10.3 3 5 0 78 327.38 6 ↓

Analogs

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Popular Name: fmoc-d-Threoninol fmoc-d-Threoninol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.18 -3.81 -10.22 3 5 0 78 327.38 6 ↓

Analogs

2379502
2379502
34650966
34650966

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Popular Name: (9H-Fluoren-9-yl)methyl (1-hydroxypropan-2-yl)carbamate (9H-Fluoren-9-yl)methyl (1-hydro…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.79 -2.73 -9.89 2 4 0 58 297.354 5 ↓

Analogs

39927537
39927537
39927538
39927538
39927539
39927539
39927540
39927540
39927541
39927541

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Popular Name: (S)-(9H-Fluoren-9-yl)methyl (1-hydroxy-4-methylpentan-2-yl)carbamate (S)-(9H-Fluoren-9-yl)methyl (1-h…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.10 -1.77 -8.77 2 4 0 58 339.435 7 ↓

Analogs

2389288
2389288

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Popular Name: Fmoc-Phenylalaninol Fmoc-Phenylalaninol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.25 -2.05 -10.36 2 4 0 58 373.452 7 ↓

Analogs

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Popular Name: Fmoc-d-leu-ol Fmoc-d-leu-ol

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.10 7.82 -8.76 2 4 0 59 339.435 7 ↓

Analogs

2379502
2379502

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Popular Name: (R)-(9H-Fluoren-9-yl)methyl (1-hydroxypropan-2-yl)carbamate (R)-(9H-Fluoren-9-yl)methyl (1-h…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.79 -2.73 -9.81 2 4 0 58 297.354 5 ↓

Analogs

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Popular Name: (S)-tert-Butyl 3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-hydroxybutanoate (S)-tert-Butyl 3-((((9H-fluoren-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.46 8.64 -14.87 2 6 0 85 397.471 9 ↓

Analogs

39309541
39309541
39309542
39309542
39648174
39648174

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Popular Name: Z-ala-nh2 Z-ala-nh2

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.96 -3.24 -9.95 3 5 0 81 222.244 5 ↓

Analogs

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Popular Name: Benzyl ((S)-1-(((S)-1-amino-1-oxopropan-2-yl)amino)-1-oxopropan-2-yl)carbamate Benzyl ((S)-1-(((S)-1-amino-1-ox…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.40 -4.75 -11.43 4 7 0 110 293.323 7 ↓

Analogs

3648053
3648053
3648055
3648055

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Popular Name: Z-ala-ala-ome Z-ala-ala-ome

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.97 4.23 -8.96 2 7 0 94 308.334 8 ↓

Analogs

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Popular Name: Z-ala-phe-ome Z-ala-phe-ome

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.43 -0.04 -13.02 2 7 0 93 384.432 10 ↓

Analogs

4535963
4535963

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Popular Name: (2S)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-hydroxy-propionic-acid-methyl-ester (2S)-2-[[(2S)-2-(benzyloxycarbon…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.00 -3.59 -10.71 3 8 0 113 324.333 9 ↓

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page.format = targets
page.num = 1
catalog.name = bachem
filter.purchasability = purchasable

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SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id  WHERE c.free = 1 AND c.short_name LIKE 'bachem' AND ci.sub_id_fk IN (SELECT ci.sub_id_fk AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id  WHERE c.free = 1 AND c.purchasable IN (1,2,4,5)   )    LIMIT 50

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