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Analogs

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Popular Name: 4-(pyridazin-3-ylamino)cyclohexanecarboxylic 4-(pyridazin-3-ylamino)cyclohexa…

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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) 0.74 5.6 -55.28 1 5 -1 78 220.252 3 ↓
Mid Mid (pH 6-8) 0.74 5.77 -59.03 2 5 0 79 221.26 3 ↓
Mid Mid (pH 6-8) 0.74 5.76 -66.52 2 5 0 79 221.26 3 ↓

Analogs

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Popular Name: N-cyclohexyl-N-pyridazin-3-yl-propane-1,3-diamine N-cyclohexyl-N-pyridazin-3-yl-pr…

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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) 1.42 5.81 -53.17 3 4 1 57 235.355 5 ↓
Mid Mid (pH 6-8) 1.42 5.97 -94.09 4 4 2 58 236.363 5 ↓
Mid Mid (pH 6-8) 1.42 5.47 -95.46 4 4 2 58 236.363 5 ↓

Analogs

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Popular Name: N1-pyridazin-3-ylcyclohexane-1,4-diamine N1-pyridazin-3-ylcyclohexane-1,4…

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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) -0.02 2.28 -48.25 4 4 1 65 193.274 2 ↓
Mid Mid (pH 6-8) -0.02 2.44 -86.69 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) -0.02 2.46 -89.14 5 4 2 67 194.282 2 ↓

Analogs

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Popular Name: N-cyclohexylpyridazin-3-amine N-cyclohexylpyridazin-3-amine

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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) 2.10 4.75 -6.85 1 3 0 38 177.251 2 ↓
Mid Mid (pH 6-8) 2.10 4.92 -27.86 2 3 1 39 178.259 2 ↓
Mid Mid (pH 6-8) 2.10 4.91 -31.07 2 3 1 39 178.259 2 ↓

Analogs

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Popular Name: 4-(pyridazin-3-ylamino)cyclohexanol 4-(pyridazin-3-ylamino)cyclohexanol

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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) 0.48 1.41 -8.56 2 4 0 58 193.25 2 ↓
Mid Mid (pH 6-8) 0.48 1.58 -30.73 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.48 1.57 -33.42 3 4 1 59 194.258 2 ↓

Analogs

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Popular Name: N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]pyridazin-3-amine N-[(1S,2R,3R)-2,3-dimethylcycloh…

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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) 2.58 5.66 -6.58 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.58 5.83 -31.24 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.58 5.83 -28.16 2 3 1 39 206.313 2 ↓

Analogs

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Popular Name: N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]pyridazin-3-amine N-[(1S,2R,3S)-2,3-dimethylcycloh…

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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) 2.58 6.3 -6.87 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.58 6.47 -28.28 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.58 6.47 -31.26 2 3 1 39 206.313 2 ↓

Analogs

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Popular Name: N-[(1R,2R,3R)-2,3-dimethylcyclohexyl]pyridazin-3-amine N-[(1R,2R,3R)-2,3-dimethylcycloh…

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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) 2.58 5.76 -6.51 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.58 5.93 -31.19 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.58 5.94 -28.12 2 3 1 39 206.313 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]pyridazin-3-amine N-[(1R,2R,3S)-2,3-dimethylcycloh…

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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) 2.58 5.97 -6.46 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.58 6.15 -28.08 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.58 6.14 -31.12 2 3 1 39 206.313 2 ↓

Analogs

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Popular Name: N-[(1S,2R)-2-methylcyclohexyl]pyridazin-3-amine N-[(1S,2R)-2-methylcyclohexyl]py…

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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) 2.34 5.83 -6.94 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.34 6 -31.12 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.34 6 -27.99 2 3 1 39 192.286 2 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-methylcyclohexyl]pyridazin-3-amine N-[(1S,2S)-2-methylcyclohexyl]py…

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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) 2.34 5.51 -6.56 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.34 5.68 -30.94 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.34 5.68 -27.87 2 3 1 39 192.286 2 ↓

Analogs

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Popular Name: N-[(1R,2R)-2-methylcyclohexyl]pyridazin-3-amine N-[(1R,2R)-2-methylcyclohexyl]py…

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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) 2.34 5.51 -6.58 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.34 5.68 -30.96 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.34 5.68 -27.92 2 3 1 39 192.286 2 ↓

Analogs

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Popular Name: N-[(1R,2S)-2-methylcyclohexyl]pyridazin-3-amine N-[(1R,2S)-2-methylcyclohexyl]py…

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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) 2.34 5.82 -6.95 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.34 6 -27.99 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.34 5.99 -31.1 2 3 1 39 192.286 2 ↓

Analogs

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Popular Name: N-(4-methylcyclohexyl)pyridazin-3-amine N-(4-methylcyclohexyl)pyridazin-…

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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) 1.87 5.35 -6.76 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 1.87 5.53 -28.16 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 1.87 5.53 -31.25 2 3 1 39 192.286 2 ↓

Analogs

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Popular Name: N-[(1S,3R)-3-methylcyclohexyl]pyridazin-3-amine N-[(1S,3R)-3-methylcyclohexyl]py…

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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) 2.10 5.36 -6.72 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.10 5.53 -28.16 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.10 5.53 -31.22 2 3 1 39 192.286 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,3S)-3-methylcyclohexyl]pyridazin-3-amine N-[(1S,3S)-3-methylcyclohexyl]py…

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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) 2.10 5.66 -7.16 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.10 5.83 -28.43 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.10 5.83 -31.36 2 3 1 39 192.286 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3R)-3-methylcyclohexyl]pyridazin-3-amine N-[(1R,3R)-3-methylcyclohexyl]py…

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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) 2.10 5.65 -7.14 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.10 5.83 -28.42 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.10 5.82 -31.34 2 3 1 39 192.286 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,3S)-3-methylcyclohexyl]pyridazin-3-amine N-[(1R,3S)-3-methylcyclohexyl]py…

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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) 2.10 5.35 -6.73 1 3 0 38 191.278 2 ↓
Mid Mid (pH 6-8) 2.10 5.53 -31.25 2 3 1 39 192.286 2 ↓
Mid Mid (pH 6-8) 2.10 5.53 -28.15 2 3 1 39 192.286 2 ↓

Analogs

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Popular Name: 4-(pyridazin-3-ylamino)cyclohexanecarboxamide 4-(pyridazin-3-ylamino)cyclohexa…

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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) 0.22 1.71 -16.54 3 5 0 81 220.276 3 ↓
Mid Mid (pH 6-8) 0.22 1.87 -38.94 4 5 1 82 221.284 3 ↓
Mid Mid (pH 6-8) 0.22 1.88 -35.75 4 5 1 82 221.284 3 ↓

Analogs

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Popular Name: N-[(1S,2R)-2-ethylcyclohexyl]pyridazin-3-amine N-[(1S,2R)-2-ethylcyclohexyl]pyr…

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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) 2.84 6.45 -6.86 1 3 0 38 205.305 3 ↓
Mid Mid (pH 6-8) 2.84 6.63 -31.34 2 3 1 39 206.313 3 ↓
Mid Mid (pH 6-8) 2.84 6.63 -28.42 2 3 1 39 206.313 3 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-ethylcyclohexyl]pyridazin-3-amine N-[(1S,2S)-2-ethylcyclohexyl]pyr…

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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) 2.84 6.16 -6.54 1 3 0 38 205.305 3 ↓
Mid Mid (pH 6-8) 2.84 6.34 -31.11 2 3 1 39 206.313 3 ↓
Mid Mid (pH 6-8) 2.84 6.34 -28.15 2 3 1 39 206.313 3 ↓

Analogs

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Popular Name: N-[(1R,2R)-2-ethylcyclohexyl]pyridazin-3-amine N-[(1R,2R)-2-ethylcyclohexyl]pyr…

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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) 2.84 6.16 -6.55 1 3 0 38 205.305 3 ↓
Mid Mid (pH 6-8) 2.84 6.34 -28.18 2 3 1 39 206.313 3 ↓
Mid Mid (pH 6-8) 2.84 6.33 -31.14 2 3 1 39 206.313 3 ↓

Analogs

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Popular Name: N-[(1R,2S)-2-ethylcyclohexyl]pyridazin-3-amine N-[(1R,2S)-2-ethylcyclohexyl]pyr…

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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) 2.84 6.45 -6.83 1 3 0 38 205.305 3 ↓
Mid Mid (pH 6-8) 2.84 6.63 -28.4 2 3 1 39 206.313 3 ↓
Mid Mid (pH 6-8) 2.84 6.62 -31.29 2 3 1 39 206.313 3 ↓

Analogs

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Popular Name: N-(4-ethylcyclohexyl)pyridazin-3-amine N-(4-ethylcyclohexyl)pyridazin-3…

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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) 2.55 6.31 -7.14 1 3 0 38 205.305 3 ↓
Mid Mid (pH 6-8) 2.55 6.48 -28.47 2 3 1 39 206.313 3 ↓
Mid Mid (pH 6-8) 2.55 6.48 -31.35 2 3 1 39 206.313 3 ↓

Analogs

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Popular Name: N-(4-propylcyclohexyl)pyridazin-3-amine N-(4-propylcyclohexyl)pyridazin-…

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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 7.06 -7.13 1 3 0 38 219.332 4 ↓
Mid Mid (pH 6-8) 3.11 7.24 -28.57 2 3 1 39 220.34 4 ↓
Mid Mid (pH 6-8) 3.11 7.23 -31.34 2 3 1 39 220.34 4 ↓

Analogs

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Popular Name: (1S,2R)-2-(pyridazin-3-ylamino)cyclohexanol (1S,2R)-2-(pyridazin-3-ylamino)c…

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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) 0.95 1.93 -27.7 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.95 1.76 -9.39 2 4 0 58 193.25 2 ↓
Mid Mid (pH 6-8) 0.95 1.93 -31.64 3 4 1 59 194.258 2 ↓

Analogs

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Popular Name: (1S,2S)-2-(pyridazin-3-ylamino)cyclohexanol (1S,2S)-2-(pyridazin-3-ylamino)c…

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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) 0.95 1.61 -27.64 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.95 1.61 -31.5 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.95 1.44 -8.86 2 4 0 58 193.25 2 ↓

Analogs

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Popular Name: (1R,2R)-2-(pyridazin-3-ylamino)cyclohexanol (1R,2R)-2-(pyridazin-3-ylamino)c…

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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) 0.95 1.61 -27.62 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.95 1.61 -31.5 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.95 1.44 -8.87 2 4 0 58 193.25 2 ↓

Analogs

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Popular Name: (1R,2S)-2-(pyridazin-3-ylamino)cyclohexanol (1R,2S)-2-(pyridazin-3-ylamino)c…

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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) 0.95 1.81 -28.68 3 4 1 59 194.258 2 ↓
Mid Mid (pH 6-8) 0.95 1.64 -9 2 4 0 58 193.25 2 ↓
Mid Mid (pH 6-8) 0.95 1.81 -32.64 3 4 1 59 194.258 2 ↓

Analogs

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Popular Name: (1R,2S)-N1-pyridazin-3-ylcyclohexane-1,2-diamine (1R,2S)-N1-pyridazin-3-ylcyclohe…

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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) 0.45 2.69 -102.06 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) 0.45 2.69 -97.42 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) 0.45 2.52 -50.79 4 4 1 65 193.274 2 ↓

Analogs

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Popular Name: (1S,2S)-N1-pyridazin-3-ylcyclohexane-1,2-diamine (1S,2S)-N1-pyridazin-3-ylcyclohe…

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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) 0.45 2.38 -101.13 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) 0.45 2.2 -48.5 4 4 1 65 193.274 2 ↓
Mid Mid (pH 6-8) 0.45 2.37 -95.94 5 4 2 67 194.282 2 ↓

Analogs

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Popular Name: (1R,2R)-N1-pyridazin-3-ylcyclohexane-1,2-diamine (1R,2R)-N1-pyridazin-3-ylcyclohe…

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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) 0.45 2.38 -101.1 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) 0.45 2.2 -48.52 4 4 1 65 193.274 2 ↓
Mid Mid (pH 6-8) 0.45 2.37 -95.96 5 4 2 67 194.282 2 ↓

Analogs

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Popular Name: (1S,2R)-N1-pyridazin-3-ylcyclohexane-1,2-diamine (1S,2R)-N1-pyridazin-3-ylcyclohe…

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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) 0.45 2.69 -102.03 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) 0.45 2.69 -97.41 5 4 2 67 194.282 2 ↓
Mid Mid (pH 6-8) 0.45 2.52 -50.76 4 4 1 65 193.274 2 ↓

Analogs

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Popular Name: 2-[cyclohexyl(pyridazin-3-yl)amino]ethanol 2-[cyclohexyl(pyridazin-3-yl)ami…

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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) 1.71 4.42 -8.83 1 4 0 49 221.304 4 ↓
Mid Mid (pH 6-8) 1.71 4.35 -27.05 2 4 1 50 222.312 4 ↓
Mid Mid (pH 6-8) 1.71 4.58 -33.28 2 4 1 50 222.312 4 ↓

Analogs

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Popular Name: 6-chloro-N-[(1S,2R,4R)-2,4-dimethylcyclohexyl]pyridazin-3-amine 6-chloro-N-[(1S,2R,4R)-2,4-dimet…

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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) 3.56 6.83 -6.39 1 3 0 38 239.75 2 ↓

Analogs

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Popular Name: 6-chloro-N-[(1S,2R,4S)-2,4-dimethylcyclohexyl]pyridazin-3-amine 6-chloro-N-[(1S,2R,4S)-2,4-dimet…

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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) 3.56 6.2 -5.93 1 3 0 38 239.75 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-chloro-N-[(1R,2R,4R)-2,4-dimethylcyclohexyl]pyridazin-3-amine 6-chloro-N-[(1R,2R,4R)-2,4-dimet…

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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) 3.56 6.54 -5.81 1 3 0 38 239.75 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-chloro-N-[(1R,2R,4S)-2,4-dimethylcyclohexyl]pyridazin-3-amine 6-chloro-N-[(1R,2R,4S)-2,4-dimet…

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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) 3.56 6.29 -5.83 1 3 0 38 239.75 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,4R)-2,4-dimethylcyclohexyl]pyridazin-3-amine N-[(1S,2R,4R)-2,4-dimethylcycloh…

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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) 2.34 6.43 -6.88 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.34 6.6 -28.29 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.34 6.6 -31.25 2 3 1 39 206.313 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R,4S)-2,4-dimethylcyclohexyl]pyridazin-3-amine N-[(1S,2R,4S)-2,4-dimethylcycloh…

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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) 2.34 5.79 -6.6 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.34 5.96 -28.21 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.34 5.96 -31.26 2 3 1 39 206.313 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,4R)-2,4-dimethylcyclohexyl]pyridazin-3-amine N-[(1R,2R,4R)-2,4-dimethylcycloh…

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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) 2.34 6.12 -6.48 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.34 6.29 -28.16 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.34 6.29 -31.14 2 3 1 39 206.313 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R,4S)-2,4-dimethylcyclohexyl]pyridazin-3-amine N-[(1R,2R,4S)-2,4-dimethylcycloh…

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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) 2.34 5.88 -6.46 1 3 0 38 205.305 2 ↓
Mid Mid (pH 6-8) 2.34 6.06 -28.18 2 3 1 39 206.313 2 ↓
Mid Mid (pH 6-8) 2.34 6.05 -31.16 2 3 1 39 206.313 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S,4S)-2,4-dimethylcyclohexyl]-6-methyl-pyridazin-3-amine N-[(1R,2S,4S)-2,4-dimethylcycloh…

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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) 2.59 7.14 -27.64 2 3 1 39 220.34 2 ↓
Mid Mid (pH 6-8) 2.59 7.03 -7.17 1 3 0 38 219.332 2 ↓
Mid Mid (pH 6-8) 2.59 7.2 -27.1 2 3 1 39 220.34 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S,4S)-2,4-dimethylcyclohexyl]-6-methyl-pyridazin-3-amine N-[(1S,2S,4S)-2,4-dimethylcycloh…

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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) 2.59 6.84 -27.46 2 3 1 39 220.34 2 ↓
Mid Mid (pH 6-8) 2.59 6.72 -6.7 1 3 0 38 219.332 2 ↓
Mid Mid (pH 6-8) 2.59 6.9 -26.96 2 3 1 39 220.34 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S,4R)-2,4-dimethylcyclohexyl]-6-methyl-pyridazin-3-amine N-[(1R,2S,4R)-2,4-dimethylcycloh…

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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) 2.59 6.5 -27.56 2 3 1 39 220.34 2 ↓
Mid Mid (pH 6-8) 2.59 6.39 -6.82 1 3 0 38 219.332 2 ↓
Mid Mid (pH 6-8) 2.59 6.56 -27.03 2 3 1 39 220.34 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S,4R)-2,4-dimethylcyclohexyl]-6-methyl-pyridazin-3-amine N-[(1S,2S,4R)-2,4-dimethylcycloh…

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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) 2.59 6.61 -27.49 2 3 1 39 220.34 2 ↓
Mid Mid (pH 6-8) 2.59 6.49 -6.74 1 3 0 38 219.332 2 ↓
Mid Mid (pH 6-8) 2.59 6.66 -26.99 2 3 1 39 220.34 2 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.44 7 -7.9 1 5 0 64 263.341 4 ↓
Lo Low (pH 4.5-6) 2.44 7.16 -28.38 2 5 1 65 264.349 4 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.44 6.37 -7.38 1 5 0 64 263.341 4 ↓
Lo Low (pH 4.5-6) 2.44 6.53 -28.08 2 5 1 65 264.349 4 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.44 6.7 -7.28 1 5 0 64 263.341 4 ↓
Lo Low (pH 4.5-6) 2.44 6.86 -27.96 2 5 1 65 264.349 4 ↓

Analogs

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Popular Name: methyl methyl

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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) 2.44 6.46 -7.33 1 5 0 64 263.341 4 ↓
Lo Low (pH 4.5-6) 2.44 6.63 -28.01 2 5 1 65 264.349 4 ↓

Parameters Provided:

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