UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (4-chlorophenyl)-ethyl-(2-methoxyethyl)-methyl-BLAHtetrone (4-chlorophenyl)-ethyl-(2-methox…

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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) 1.07 8.6 -16.32 0 8 0 87 433.892 5 ↓

Analogs

15941125
15941125

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Popular Name: benzyl-butyl-(4-chlorophenyl)-ethyl-BLAHtetrone benzyl-butyl-(4-chlorophenyl)-et…

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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) 3.95 13.69 -14.63 0 7 0 78 508.018 7 ↓

Analogs

15941123
15941123
15941131
15941131

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Popular Name: butyl-(4-chlorophenyl)-ethyl-methyl-BLAHtetrone butyl-(4-chlorophenyl)-ethyl-met…

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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) 2.52 10.45 -15.44 0 7 0 78 431.92 5 ↓

Analogs

15941131
15941131
15941121
15941121

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Popular Name: (4-chlorophenyl)-(cyclopropylmethyl)-ethyl-methyl-BLAHtetrone (4-chlorophenyl)-(cyclopropylmet…

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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) 1.95 10.53 -16.23 0 7 0 78 429.904 4 ↓

Analogs

15941119
15941119

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Popular Name: benzyl-(4-chlorophenyl)-(cyclopropylmethyl)-ethyl-BLAHtetrone benzyl-(4-chlorophenyl)-(cyclopr…

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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) 3.38 14.02 -13.48 0 7 0 78 506.002 6 ↓

Analogs

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Popular Name: benzyl-(4-chlorophenyl)-ethyl-(2-methoxyethyl)BLAHtetrone benzyl-(4-chlorophenyl)-ethyl-(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) 2.49 12.12 -14.09 0 8 0 87 509.99 7 ↓

Analogs

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Popular Name: benzyl-ethyl-(2-methoxyethyl)-(4-methoxyphenyl)BLAHtetrone benzyl-ethyl-(2-methoxyethyl)-(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) 1.87 10.89 -15.71 0 9 0 96 505.571 8 ↓

Analogs

15941121
15941121

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Popular Name: benzyl-(4-chlorophenyl)-ethyl-methyl-BLAHtetrone benzyl-(4-chlorophenyl)-ethyl-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) 2.48 11.93 -16.06 0 7 0 78 465.937 4 ↓

Analogs

15974651
15974651

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Popular Name: benzyl-ethyl-(4-methoxyphenyl)-methyl-BLAHtetrone benzyl-ethyl-(4-methoxyphenyl)-m…

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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 10.71 -17.71 0 8 0 87 461.518 5 ↓

Analogs

38145434
38145434

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Popular Name: benzyl-butyl-ethyl-(4-methoxyphenyl)BLAHtetrone benzyl-butyl-ethyl-(4-methoxyphe…

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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) 3.33 12.48 -15.6 0 8 0 87 503.599 8 ↓

Analogs

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Popular Name: cyclopropylmethyl-ethyl-(4-methoxyphenyl)-methyl-BLAHtetrone cyclopropylmethyl-ethyl-(4-metho…

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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) 1.33 9.29 -17.98 0 8 0 87 425.485 5 ↓

Analogs

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Popular Name: ethyl-(2-methoxyethyl)-(4-methoxyphenyl)-methyl-BLAHtetrone ethyl-(2-methoxyethyl)-(4-methox…

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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) 0.44 7.38 -17.85 0 9 0 96 429.473 6 ↓

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) 0.16 10.06 -24.5 1 11 0 138 509.515 8 ↓

Analogs

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Popular Name: benzyl-methyl-(5-methyl-2-furyl)-(2-pyridylmethyl)BLAHtetrone benzyl-methyl-(5-methyl-2-furyl)…

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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) 1.16 12.88 -21.34 0 9 0 104 498.539 5 ↓
Lo Low (pH 4.5-6) 1.16 13.31 -40.97 1 9 1 105 499.547 5 ↓

Analogs

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Popular Name: dibenzyl-methyl-(5-methyl-2-furyl)BLAHtetrone dibenzyl-methyl-(5-methyl-2-fury…

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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) 2.33 14.62 -20.22 0 8 0 91 497.551 5 ↓

Analogs

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Popular Name: benzyl-(2-hydroxyethyl)-methyl-(5-methyl-2-furyl)BLAHtetrone benzyl-(2-hydroxyethyl)-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) 0.30 9.17 -21.18 1 9 0 111 451.479 5 ↓

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) -0.04 8.71 -18.56 1 10 0 125 469.494 8 ↓

Analogs

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Popular Name: benzyl-cyclopropyl-(2-hydroxyethyl)-methyl-BLAHtetrone benzyl-cyclopropyl-(2-hydroxyeth…

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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) 0.10 7.33 -14.72 1 8 0 98 411.458 5 ↓

Analogs

39687275
39687275

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Popular Name: benzyl-cyclopropyl-methyl-(2-pyridylmethyl)BLAHtetrone benzyl-cyclopropyl-methyl-(2-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) 0.96 10.62 -14.57 0 8 0 91 458.518 5 ↓
Lo Low (pH 4.5-6) 0.96 11.13 -36.61 1 8 1 92 459.526 5 ↓

Analogs

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Popular Name: benzyl-(2-hydroxyethyl)-methyl-styryl-BLAHtetrone benzyl-(2-hydroxyethyl)-methyl-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) 1.58 10.15 -17.97 1 8 0 98 473.529 6 ↓

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) -0.40 9.52 -20.8 0 11 0 130 480.477 6 ↓
Lo Low (pH 4.5-6) -0.40 9.96 -38.96 1 11 1 132 481.485 6 ↓

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) -1.26 5.72 -21.16 1 11 0 138 433.417 6 ↓

Analogs

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Popular Name: dimethyl-(5-methyl-2-furyl)-(2-pyridylmethyl)BLAHtetrone dimethyl-(5-methyl-2-furyl)-(2-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) -0.27 8.31 -19.8 0 9 0 104 422.441 3 ↓
Lo Low (pH 4.5-6) -0.27 8.76 -41.03 1 9 1 105 423.449 3 ↓

Analogs

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Popular Name: 2-hydroxyethyl-dimethyl-(5-methyl-2-furyl)BLAHtetrone 2-hydroxyethyl-dimethyl-(5-methy…

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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) -1.13 4.52 -20.78 1 9 0 111 375.381 3 ↓

Analogs

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Popular Name: methyl-(5-methyl-2-furyl)-phenyl-(2-pyridylmethyl)BLAHtetrone methyl-(5-methyl-2-furyl)-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) 1.43 11.46 -20.61 0 9 0 104 484.512 4 ↓
Lo Low (pH 4.5-6) 1.43 11.92 -41.81 1 9 1 105 485.52 4 ↓

Analogs

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Popular Name: dimethyl-(5-methyl-2-furyl)-[(4-phenylphenyl)methyl]BLAHtetrone dimethyl-(5-methyl-2-furyl)-[(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) 2.70 13.52 -20.82 0 8 0 91 497.551 4 ↓

Analogs

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Popular Name: benzyl-dimethyl-(5-methyl-2-furyl)BLAHtetrone benzyl-dimethyl-(5-methyl-2-fury…

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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) 0.90 10.11 -19.67 0 8 0 91 421.453 3 ↓

Analogs

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Popular Name: cyclopropylmethyl-dimethyl-(5-methyl-2-furyl)BLAHtetrone cyclopropylmethyl-dimethyl-(5-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) 0.38 8.69 -20.06 0 8 0 91 385.42 3 ↓

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) 0.77 11.32 -20.8 0 10 0 117 479.489 6 ↓

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) 0.24 9.9 -21.81 0 10 0 117 443.456 6 ↓

Analogs

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Popular Name: cyclopropylmethyl-methyl-(5-methyl-2-furyl)-phenyl-BLAHtetrone cyclopropylmethyl-methyl-(5-meth…

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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) 2.07 11.84 -21.24 0 8 0 91 447.491 4 ↓

Analogs

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Popular Name: 2-hydroxyethyl-methyl-phenyl-styryl-BLAHtetrone 2-hydroxyethyl-methyl-phenyl-sty…

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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) 1.85 9.77 -21.23 1 8 0 98 459.502 5 ↓

Analogs

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Popular Name: cyclopropylmethyl-methyl-phenyl-styryl-BLAHtetrone cyclopropylmethyl-methyl-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) 3.35 13.46 -21.14 0 7 0 78 469.541 5 ↓

Analogs

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Popular Name: cyclopropyl-(cyclopropylmethyl)-methyl-phenyl-BLAHtetrone cyclopropyl-(cyclopropylmethyl)-…

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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 11.31 -16.96 0 7 0 78 407.47 4 ↓

Analogs

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Popular Name: cyclopropyl-dimethyl-[(4-phenylphenyl)methyl]BLAHtetrone cyclopropyl-dimethyl-[(4-phenylp…

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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) 2.50 13.08 -17 0 7 0 78 457.53 4 ↓

Analogs

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Popular Name: benzyl-cyclopropyl-dimethyl-BLAHtetrone benzyl-cyclopropyl-dimethyl-BLAH…

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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) 0.70 9.66 -15.32 0 7 0 78 381.432 3 ↓

Analogs

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Popular Name: cyclopropyl-(cyclopropylmethyl)-dimethyl-BLAHtetrone cyclopropyl-(cyclopropylmethyl)-…

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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) 0.17 8.23 -15.29 0 7 0 78 345.399 3 ↓

Analogs

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Popular Name: cyclopropylmethyl-dimethyl-styryl-BLAHtetrone cyclopropylmethyl-dimethyl-styry…

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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) 1.65 10.02 -18.06 0 7 0 78 407.47 4 ↓

Analogs

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Popular Name: benzyl-dimethyl-styryl-BLAHtetrone benzyl-dimethyl-styryl-BLAHtetrone

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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) 2.18 11.4 -18.04 0 7 0 78 443.503 4 ↓

Analogs

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Popular Name: 2-hydroxyethyl-dimethyl-styryl-BLAHtetrone 2-hydroxyethyl-dimethyl-styryl-B…

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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) 0.15 6.33 -18.97 1 8 0 98 397.431 4 ↓

Analogs

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Popular Name: dimethyl-(2-pyridylmethyl)-styryl-BLAHtetrone dimethyl-(2-pyridylmethyl)-styry…

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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) 1.01 9.63 -18.54 0 8 0 91 444.491 4 ↓
Lo Low (pH 4.5-6) 1.01 10.14 -40.43 1 8 1 92 445.499 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) 2.04 12.77 -20.16 0 9 0 104 501.539 7 ↓

Analogs

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Popular Name: benzyl-methyl-(5-methyl-2-furyl)-phenyl-BLAHtetrone benzyl-methyl-(5-methyl-2-furyl)…

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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) 2.60 13.26 -20.57 0 8 0 91 483.524 4 ↓

Parameters Provided:

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