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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K96554170-001-01-8 BRD-K96554170-001-01-8

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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) 3.89 -2.39 -12.65 1 7 0 84 433.313 7 ↓

Analogs

38409
38409

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Popular Name: BRD-K85808180-001-01-9 BRD-K85808180-001-01-9

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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) 3.72 -2.25 -16.21 3 5 0 81 380.469 6 ↓

Analogs

6601153
6601153

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Popular Name: BRD-K13242651-001-01-8 BRD-K13242651-001-01-8

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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) 3.11 -4.37 -18.82 1 7 0 84 412.467 5 ↓

Analogs

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Popular Name: BRD-K24816163-001-01-7 BRD-K24816163-001-01-7

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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) 5.71 -2.99 -11.04 1 6 0 75 509.809 7 ↓

Analogs

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Popular Name: BRD-K68268084-001-01-4 BRD-K68268084-001-01-4

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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) 3.72 0.6 -12.83 1 7 0 85 398.22 3 ↓

Analogs

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Popular Name: BRD-K83318755-001-01-6 BRD-K83318755-001-01-6

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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) 5.11 -1.44 -11.09 1 4 0 51 372.515 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A33807913-001-01-0 BRD-A33807913-001-01-0

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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) 3.67 8.23 -18.11 1 8 0 104 513.641 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A33807913-001-01-0 BRD-A33807913-001-01-0

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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) 3.67 8.41 -16.73 1 8 0 104 513.641 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A92492386-001-01-7 BRD-A92492386-001-01-7

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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) 1.89 0.24 -11.9 3 6 0 87 267.672 3 ↓
Hi High (pH 8-9.5) 2.08 -2.41 -41.53 2 6 -1 94 266.664 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A92492386-001-01-7 BRD-A92492386-001-01-7

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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) 1.89 0.23 -11.95 3 6 0 87 267.672 3 ↓
Hi High (pH 8-9.5) 2.08 -2.42 -41.59 2 6 -1 94 266.664 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K09008500-001-01-2 BRD-K09008500-001-01-2

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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) 3.71 6.46 -22.07 3 7 0 103 395.488 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2-furylmethyl)-N'-pyridin-3-ylthiourea N-(2-furylmethyl)-N'-pyridin-3-y…

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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) 0.93 4.53 -11.23 2 4 0 50 233.296 5 ↓
Lo Low (pH 4.5-6) 0.93 4.82 -40.38 3 4 1 51 234.304 5 ↓

Analogs

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Popular Name: BRD-K22970336-001-01-6 BRD-K22970336-001-01-6

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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) 1.86 0.18 -12.99 1 4 0 46 265.313 4 ↓
Lo Low (pH 4.5-6) 1.86 0.43 -41.25 2 4 1 48 266.321 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K60628281-001-01-8 BRD-K60628281-001-01-8

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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) 3.67 -3.64 -21.69 2 7 0 93 492.475 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K50658606-001-01-5 BRD-K50658606-001-01-5

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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) 1.55 2.57 -8.27 2 6 0 71 384.274 6 ↓

Analogs

929821
929821

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Popular Name: BRD-K31308316-001-01-2 BRD-K31308316-001-01-2

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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) 4.85 11.81 -12.58 0 5 0 61 434.542 5 ↓

Analogs

32206654
32206654

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Popular Name: BRD-K00434646-001-01-4 BRD-K00434646-001-01-4

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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) 3.25 8.16 -16.93 1 4 0 51 371.234 5 ↓
Lo Low (pH 4.5-6) 3.25 8.57 -47.48 2 4 1 52 372.242 5 ↓

Analogs

16014351
16014351
25096286
25096286
27972653
27972653

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Popular Name: BRD-K34942914-001-01-1 BRD-K34942914-001-01-1

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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) 2.42 6.81 -20.13 1 7 0 87 435.933 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K01738302-001-01-2 BRD-K01738302-001-01-2

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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) 4.26 8.12 -17.82 1 5 0 66 392.908 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K50390941-001-01-9 BRD-K50390941-001-01-9

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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) 0.83 -2.33 -22.01 1 9 0 108 433.515 4 ↓

Analogs

33779248
33779248

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Popular Name: BRD-K76983342-001-01-6 BRD-K76983342-001-01-6

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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) 5.99 8.36 -23.4 1 6 0 77 433.895 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K06872392-001-01-5 BRD-K06872392-001-01-5

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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) 6.30 14.51 -12.96 1 5 0 60 469.397 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K11927892-001-01-5 BRD-K11927892-001-01-5

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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) 4.05 8.77 -13.91 1 5 0 68 359.838 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A20806805-001-01-8 BRD-A20806805-001-01-8

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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) 4.51 10.43 -34.14 2 6 0 84 411.461 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A20806805-001-01-8 BRD-A20806805-001-01-8

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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) 4.51 10.38 -28.24 2 6 0 84 411.461 5 ↓

Analogs

16250000
16250000

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Popular Name: BRD-K96708202-001-01-2 BRD-K96708202-001-01-2

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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) 3.41 -2.45 -15.32 1 6 0 90 398.271 5 ↓

Analogs

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Popular Name: BRD-K90631017-001-01-7 BRD-K90631017-001-01-7

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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) 1.81 3.68 -19.11 1 6 0 79 339.804 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K78658237-001-01-0 BRD-K78658237-001-01-0

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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) 2.85 -2.4 -15.69 1 6 0 90 363.826 5 ↓

Analogs

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Popular Name: BRD-K70309634-001-01-7 BRD-K70309634-001-01-7

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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) 2.53 7.59 -15.32 2 7 0 89 370.434 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K59129409-001-01-7 BRD-K59129409-001-01-7

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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 3.65 -14.9 0 7 0 89 364.814 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K89385823-001-01-7 BRD-K89385823-001-01-7

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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) 4.78 -3.88 -14.27 1 5 0 54 463.987 6 ↓

Analogs

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Popular Name: BRD-K01169369-001-01-0 BRD-K01169369-001-01-0

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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) 4.29 0.31 -10.66 2 5 0 67 374.44 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K65626516-001-01-4 BRD-K65626516-001-01-4

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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 -0.54 -14.76 1 6 0 73 465.6 7 ↓

Analogs

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Popular Name: BRD-K65371988-001-01-6 BRD-K65371988-001-01-6

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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) 5.96 13.26 -18.05 1 6 0 73 462.962 5 ↓

Analogs

16381993
16381993
5077547
5077547

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Popular Name: BRD-A22114446-001-01-0 BRD-A22114446-001-01-0

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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) 2.90 0.7 -17.16 1 6 0 67 396.487 6 ↓

Analogs

5077549
5077549

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Popular Name: BRD-A22114446-001-01-0 BRD-A22114446-001-01-0

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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) 2.90 0.73 -16.12 1 6 0 67 396.487 6 ↓

Analogs

5077549
5077549

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Popular Name: BRD-A22114446-001-01-0 BRD-A22114446-001-01-0

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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) 2.90 9.46 -18.81 1 6 0 68 396.487 6 ↓

Analogs

25094641
25094641
25096286
25096286
25529815
25529815
25535502
25535502
25535507
25535507

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Popular Name: BRD-K36282724-001-01-0 BRD-K36282724-001-01-0

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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) 3.43 -4.14 -15.73 1 7 0 86 465.575 6 ↓

Analogs

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Popular Name: BRD-K17643132-001-01-2 BRD-K17643132-001-01-2

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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) 2.89 4.5 -10.56 3 5 0 81 324.475 4 ↓

Analogs

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Popular Name: BRD-K82305965-001-01-0 BRD-K82305965-001-01-0

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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) 4.10 -0.3 -22.42 1 4 0 59 386.473 6 ↓

Analogs

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Popular Name: BRD-A53054670-001-01-7 BRD-A53054670-001-01-7

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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) 1.60 -0.91 -15.09 1 6 0 77 321.402 7 ↓

Analogs

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Popular Name: BRD-A53054670-001-01-7 BRD-A53054670-001-01-7

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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) 1.60 -0.89 -14.71 1 6 0 77 321.402 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K60438607-001-01-9 BRD-K60438607-001-01-9

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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) 2.02 0.17 -22.61 1 6 0 81 335.363 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K48390910-001-01-1 BRD-K48390910-001-01-1

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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) 4.94 5.24 -18.47 0 8 0 96 440.488 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K11668065-001-01-6 BRD-K11668065-001-01-6

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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) 2.53 5.43 -15.33 1 6 0 79 355.419 5 ↓
Lo Low (pH 4.5-6) 2.53 5.72 -46.81 2 6 1 81 356.427 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K15177768-001-01-4 BRD-K15177768-001-01-4

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Activity (Go SEA)

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) 5.33 13.97 -15.82 1 5 0 64 461.612 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K82773759-001-01-9 BRD-K82773759-001-01-9

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Activity (Go SEA)

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) 3.99 1.2 -18.52 2 7 0 93 404.422 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-K94420961-001-01-7 BRD-K94420961-001-01-7

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Activity (Go SEA)

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) 5.99 9.48 -9.91 0 5 0 57 424.957 5 ↓

Analogs

614189
614189

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A10004542-001-01-0 BRD-A10004542-001-01-0

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Activity (Go SEA)

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) 4.62 0.33 -10.05 0 5 0 61 323.396 5 ↓

Analogs

614190
614190

Draw Identity 99% 90% 80% 70%

Popular Name: BRD-A10004542-001-01-0 BRD-A10004542-001-01-0

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 4.62 0.33 -10.05 0 5 0 61 323.396 5 ↓

Parameters Provided:

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

Structural Results Found: (before additional filtering)

SQL Query Was

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 'broadviapc' 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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