UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

2597359
2597359

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Popular Name: 3-(2-nitrophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(2-nitrophenyl)sulfonyloxynaph…

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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) 3.92 -1.47 -84.77 0 8 -1 129 372.334 5 ↓

Analogs

1728594
1728594

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Popular Name: 2-(2-nitrophenyl)sulfonyloxynaphthalene 2-(2-nitrophenyl)sulfonyloxynaph…

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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) 4.00 -1.47 -19.99 0 6 0 89 329.333 4 ↓

Analogs

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Popular Name: 2-(3,5-difluorophenyl)sulfonyloxy-7-methoxy-naphthalene 2-(3,5-difluorophenyl)sulfonylox…

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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) 4.37 -1.09 -9.6 0 4 0 52 350.342 4 ↓

Analogs

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Popular Name: 3-(2,6-dichlorophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(2,6-dichlorophenyl)sulfonylox…

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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) 5.27 8.14 -47.48 0 5 -1 84 396.227 4 ↓

Analogs

13087185
13087185

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Popular Name: 3-(4-propylphenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-propylphenyl)sulfonyloxynap…

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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) 5.31 9.99 -72.04 0 5 -1 84 369.418 6 ↓

Analogs

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Popular Name: 3-(4-bromo-2-chloro-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-bromo-2-chloro-phenyl)sulfo…

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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) 5.42 8.81 -66.29 0 5 -1 84 440.678 4 ↓

Analogs

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Popular Name: 3-(4-bromo-2,6-dichloro-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-bromo-2,6-dichloro-phenyl)s…

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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) 6.03 8.77 -44.29 0 5 -1 84 475.123 4 ↓

Analogs

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Popular Name: 3-(4-acetamido-3-methoxy-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-acetamido-3-methoxy-phenyl)…

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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) 3.21 6.12 -71.68 1 8 -1 122 414.415 6 ↓

Analogs

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Popular Name: 3-(5-acetamido-2-methoxy-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(5-acetamido-2-methoxy-phenyl)…

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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) 3.21 6.3 -76.54 1 8 -1 122 414.415 6 ↓

Analogs

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Popular Name: 3-(2,3,4-trifluorophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(2,3,4-trifluorophenyl)sulfony…

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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) 4.35 7.61 -66.04 0 5 -1 84 381.307 4 ↓

Analogs

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Popular Name: 3-(3,5-dichlorophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(3,5-dichlorophenyl)sulfonylox…

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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) 5.29 8.18 -45.07 0 5 -1 84 396.227 4 ↓

Analogs

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Popular Name: 3-(2-chlorophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(2-chlorophenyl)sulfonyloxynap…

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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) 4.64 8.38 -75.11 0 5 -1 84 361.782 4 ↓

Analogs

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Popular Name: 3-[3,5-bis(trifluoromethyl)phenyl]sulfonyloxynaphthalene-2-carboxylic 3-[3,5-bis(trifluoromethyl)pheny…

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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) 5.73 9.17 -43.72 0 5 -1 84 463.331 6 ↓

Analogs

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Popular Name: 3-[3,5-bis(methoxycarbonyl)phenyl]sulfonyloxynaphthalene-2-carboxylic 3-[3,5-bis(methoxycarbonyl)pheny…

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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) 4.28 9.08 -72.54 0 9 -1 136 443.409 8 ↓

Analogs

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Popular Name: 3-(3-bromophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(3-bromophenyl)sulfonyloxynaph…

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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 8.38 -69.67 0 5 -1 84 406.233 4 ↓

Analogs

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Popular Name: 3-(3-cyanophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(3-cyanophenyl)sulfonyloxynaph…

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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 8.16 -71.05 0 6 -1 107 352.347 4 ↓

Analogs

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Popular Name: 3-(4-cyanophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-cyanophenyl)sulfonyloxynaph…

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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) 3.76 8.17 -68.4 0 6 -1 107 352.347 4 ↓

Analogs

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Popular Name: 3-(4-chloro-2-fluoro-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-chloro-2-fluoro-phenyl)sulf…

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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 8.36 -69.72 0 5 -1 84 379.772 4 ↓

Analogs

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Popular Name: 3-[4-chloro-2-(trifluoromethyl)phenyl]sulfonyloxynaphthalene-2-carboxylic 3-[4-chloro-2-(trifluoromethyl)p…

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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) 5.51 9.14 -73.27 0 5 -1 84 429.779 5 ↓

Analogs

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Popular Name: 3-(2-cyanophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(2-cyanophenyl)sulfonyloxynaph…

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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 8.12 -83.13 0 6 -1 107 352.347 4 ↓

Analogs

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Popular Name: 3-(4-bromo-3-methyl-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-bromo-3-methyl-phenyl)sulfo…

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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) 5.19 8.96 -67.37 0 5 -1 84 420.26 4 ↓

Analogs

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Popular Name: 3-(2-bromophenyl)sulfonyloxynaphthalene-2-carboxylic 3-(2-bromophenyl)sulfonyloxynaph…

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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) 4.77 8.52 -74.65 0 5 -1 84 406.233 4 ↓

Analogs

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Popular Name: 3-(4-methyl-3-nitro-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(4-methyl-3-nitro-phenyl)sulfo…

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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) 4.34 8.96 -71.55 0 8 -1 129 386.361 5 ↓

Analogs

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Popular Name: 3-[4-(diethylsulfamoyl)phenyl]sulfonyloxynaphthalene-2-carboxylic 3-[4-(diethylsulfamoyl)phenyl]su…

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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) 4.07 7.48 -69.82 0 8 -1 121 462.525 8 ↓

Analogs

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Popular Name: 3-[4-(trifluoromethoxy)phenyl]sulfonyloxynaphthalene-2-carboxylic 3-[4-(trifluoromethoxy)phenyl]su…

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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) 4.98 7.57 -66.34 0 6 -1 93 411.333 6 ↓

Analogs

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Popular Name: 3-(5-bromo-2-methoxy-phenyl)sulfonyloxynaphthalene-2-carboxylic 3-(5-bromo-2-methoxy-phenyl)sulf…

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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) 4.80 8.02 -75.12 0 6 -1 93 436.259 5 ↓

Analogs

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Popular Name: 3-[4-(trifluoromethyl)phenyl]sulfonyloxynaphthalene-2-carboxylic 3-[4-(trifluoromethyl)phenyl]sul…

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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) 4.90 8.77 -66.33 0 5 -1 84 395.334 5 ↓

Analogs

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Popular Name: 3-(3,4-dimethoxyphenyl)sulfonyloxynaphthalene-2-carboxylic 3-(3,4-dimethoxyphenyl)sulfonylo…

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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) 3.65 6.99 -71.2 0 7 -1 102 387.389 6 ↓

Analogs

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Popular Name: 2-naphthyl 2-naphthyl

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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) 4.03 8.23 -14.69 0 7 0 98 359.359 5 ↓

Analogs

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Popular Name: 2-naphthyl 2,5-diethoxybenzenesulfonate 2-naphthyl 2,5-diethoxybenzenesu…

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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) 4.88 -1.91 -14.91 0 5 0 61 372.442 7 ↓

Analogs

2979366
2979366

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Popular Name: 2-naphthyl 2,3,4-trichlorobenzenesulfonate 2-naphthyl 2,3,4-trichlorobenzen…

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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) 5.98 -2.72 -8.83 0 3 0 43 387.671 3 ↓

Analogs

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Popular Name: (1-bromo-2-naphthyl) (1-bromo-2-naphthyl)

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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) 4.83 8.05 -16.39 0 4 0 53 393.258 4 ↓

Parameters Provided:

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