UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

6012701
6012701

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 4.25 4.23 -18.27 0 7 0 102 391.379 6 ↓

Analogs

6839803
6839803
7562340
7562340

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 4.09 13.33 -13.06 0 4 0 57 352.361 5 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 4.45 5.87 -23.39 0 9 0 113 480.48 7 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 4.32 2.57 -21.52 1 6 0 85 451.544 8 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 2.13 -3.41 -28.47 1 8 0 115 466.515 8 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 3.27 0.47 -18.11 1 7 0 102 422.462 4 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 4.16 0.69 -22.38 1 7 0 102 496.61 7 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 4.16 0.69 -22.45 1 7 0 102 496.61 7 ↓

Analogs

3355264
3355264

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Popular Name: 3,8-diethyl-4-[(oxoBLAHyl)methylsulfanyl]-7-thia-3,5-diazabicyclo[4.3.0]nona-4,8,10-trien-2-one 3,8-diethyl-4-[(oxoBLAHyl)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) 4.89 1.11 -15.1 0 5 0 65 438.574 5 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 3.40 5.07 -19.78 0 7 0 94 446.503 8 ↓

Analogs

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Popular Name: 4-[4-oxo-2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]quinazolin-3-yl]benzonitr 4-[4-oxo-2-[(2-oxo-7,8-dihydro-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) 4.99 16.59 -17.32 0 6 0 89 477.545 4 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 3.36 15.11 -18.42 0 7 0 88 423.465 8 ↓

Analogs

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Popular Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2-oxo-7,8-dihydro-6H-cyclopenta…

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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) 4.66 13.05 -11.23 0 4 0 57 417.23 4 ↓

Analogs

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Popular Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2-oxo-7,8-dihydro-6H-cyclopenta…

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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) 4.19 13.75 -15.1 0 9 0 121 439.42 8 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 2.92 3.07 -14.67 1 6 0 86 391.423 5 ↓

Analogs

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Popular Name: 4-(piperazin-1-ylmethyl)-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-(piperazin-1-ylmethyl)-7,8-dih…

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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) 1.44 6.77 -50.5 2 4 1 50 285.367 2 ↓
Hi High (pH 8-9.5) 1.44 5.35 -9.34 1 4 0 45 284.359 2 ↓

Analogs

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Popular Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2-oxo-7,8-dihydro-6H-cyclopenta…

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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) 2.86 9.04 -18.28 1 7 0 103 413.451 7 ↓

Analogs

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Popular Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2-oxo-7,8-dihydro-6H-cyclopenta…

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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 10.49 -18.44 1 7 0 99 395.411 8 ↓

Analogs

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Popular Name: (5S)-2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl]-7-thia-2,4-diazaspiro[4.4]nonane-1,3 (5S)-2-[(2-oxo-7,8-dihydro-6H-cy…

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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) 1.69 8.69 -13.16 1 6 0 80 370.43 2 ↓

Analogs

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Popular Name: (5R)-2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl]-7-thia-2,4-diazaspiro[4.4]nonane-1,3 (5R)-2-[(2-oxo-7,8-dihydro-6H-cy…

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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) 1.69 8.72 -12.95 1 6 0 80 370.43 2 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 3.17 8.25 -19.09 2 7 0 117 413.451 5 ↓

Analogs

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Popular Name: 4-oxo-2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]-3-phenyl-quinazoline-7-carb 4-oxo-2-[(2-oxo-7,8-dihydro-6H-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) 5.13 15.88 -54.26 0 7 -1 105 495.536 5 ↓

Analogs

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Popular Name: (2S)-3-methyl-2-[3-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]-5-(2-thienyl)-1, (2S)-3-methyl-2-[3-[(2-oxo-7,8-d…

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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) 4.63 15.36 -52.8 0 7 -1 101 480.591 7 ↓

Analogs

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Popular Name: (2R)-3-methyl-2-[3-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]-5-(2-thienyl)-1, (2R)-3-methyl-2-[3-[(2-oxo-7,8-d…

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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) 4.63 15.37 -55.53 0 7 -1 101 480.591 7 ↓

Analogs

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Popular Name: 2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzoic 2-[(2-oxo-7,8-dihydro-6H-cyclope…

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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) 3.93 11.54 -72.69 0 5 -1 80 335.335 4 ↓

Analogs

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Popular Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (2-oxo-7,8-dihydro-6H-cyclopenta…

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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) 2.92 9.23 -18.37 2 6 0 100 363.369 5 ↓

Analogs

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Popular Name: 4-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzoic 4-[(2-oxo-7,8-dihydro-6H-cyclope…

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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) 3.90 10.88 -56.26 0 5 -1 80 335.335 4 ↓

Analogs

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Popular Name: 2-[2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylsulfanyl]thiazol-4-yl]acetic 2-[2-[(2-oxo-7,8-dihydro-6H-cycl…

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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 10.39 -59.35 0 5 -1 83 372.447 5 ↓

Analogs

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Popular Name: 5-methyl-4-oxo-3-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl]thieno[5,4-d]pyrimidine-6-c 5-methyl-4-oxo-3-[(2-oxo-7,8-dih…

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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) 2.99 11.47 -67.61 0 7 -1 105 407.427 3 ↓

Analogs

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Popular Name: 3-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzoic 3-[(2-oxo-7,8-dihydro-6H-cyclope…

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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) 3.87 10.86 -63.72 0 5 -1 80 335.335 4 ↓

Analogs

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Popular Name: 3-methoxy-4-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzoic 3-methoxy-4-[(2-oxo-7,8-dihydro-…

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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) 3.49 10.73 -56.85 0 6 -1 89 365.361 5 ↓

Analogs

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Popular Name: 2-[4-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]phenyl]acetic 2-[4-[(2-oxo-7,8-dihydro-6H-cycl…

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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 11.67 -54.15 0 5 -1 80 349.362 5 ↓

Analogs

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Popular Name: 4-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzene-1,3-dicarboxylic 4-[(2-oxo-7,8-dihydro-6H-cyclope…

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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) 3.82 11.15 -129.58 0 7 -2 120 378.336 5 ↓

Analogs

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Popular Name: 3,5-dichloro-4-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzoic 3,5-dichloro-4-[(2-oxo-7,8-dihyd…

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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 12.11 -47.11 0 5 -1 80 404.225 4 ↓

Analogs

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Popular Name: 4-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[4-(2-hydroxyphenyl)piperazin…

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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) 3.46 9.05 -11.99 1 5 0 57 376.456 3 ↓

Analogs

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Popular Name: 4-[[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[(3-fluoro-4-methoxy-phenyl)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) 3.69 10.04 -14.33 0 4 0 43 367.42 5 ↓
Mid Mid (pH 6-8) 3.69 12.37 -65.45 1 4 1 44 368.428 5 ↓

Analogs

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Popular Name: 4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[4-(thiophene-2-carbonyl)pipe…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.96 9.87 -14.88 0 5 0 54 394.496 3 ↓
Lo Low (pH 4.5-6) 2.96 12.06 -65.31 1 5 1 55 395.504 3 ↓

Analogs

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Popular Name: 6-ethyl-3-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl]thieno[2,3-d]pyrimidin-4-one 6-ethyl-3-[(2-oxo-7,8-dihydro-6H…

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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) 3.60 12.82 -21.02 0 5 0 65 378.453 3 ↓

Analogs

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Popular Name: 4-(5-fluoro-3-methyl-benzofuran-2-yl)-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-(5-fluoro-3-methyl-benzofuran-…

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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) 4.12 3.88 -8.74 0 3 0 43 334.346 1 ↓

Analogs

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Popular Name: 3-ethoxy-4-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methoxy]benzonitrile 3-ethoxy-4-[(2-oxo-7,8-dihydro-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) 3.71 12.42 -18.45 0 5 0 72 361.397 5 ↓

Analogs

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Popular Name: 2-[(oxoBLAHyl)methoxy]benzamide 2-[(oxoBLAHyl)methoxy]benzamide

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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) 3.31 0.36 -22.45 2 5 0 82 335.359 4 ↓

Analogs

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Popular Name: (oxoBLAHyl)methyl (oxoBLAHyl)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) 3.46 3.02 -18.06 0 6 0 76 403.434 5 ↓

Analogs

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Popular Name: [4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethylBLAHone [4-(2-fluorophenyl)-1,2,4-triazo…

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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) 3.97 15.41 -15.07 0 5 0 61 393.443 4 ↓

Analogs

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Popular Name: 4-[[methyl(propyl)amino]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[methyl(propyl)amino]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) 3.02 11.1 -50.84 1 3 1 35 272.368 4 ↓
Hi High (pH 8-9.5) 3.02 8.78 -8.62 0 3 0 33 271.36 4 ↓

Analogs

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Popular Name: 4-[[(3S)-3-(morpholinomethyl)-1-piperidyl]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[(3S)-3-(morpholinomethyl)-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) 2.79 8.74 -10.42 0 5 0 46 382.504 4 ↓
Mid Mid (pH 6-8) 2.79 10.97 -56.16 1 5 1 47 383.512 4 ↓
Mid Mid (pH 6-8) 2.79 10.73 -50.4 1 5 1 47 383.512 4 ↓

Analogs

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Popular Name: 4-[[(3R)-3-(morpholinomethyl)-1-piperidyl]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[(3R)-3-(morpholinomethyl)-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) 2.79 8.37 -10.55 0 5 0 46 382.504 4 ↓
Mid Mid (pH 6-8) 2.79 10.59 -55.93 1 5 1 47 383.512 4 ↓
Mid Mid (pH 6-8) 2.79 10.41 -48.16 1 5 1 47 383.512 4 ↓

Analogs

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Popular Name: 4-[[methyl-[(1S)-1-methyl-2-methylsulfonyl-ethyl]amino]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2 4-[[methyl-[(1S)-1-methyl-2-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) 1.87 6.75 -17.64 0 5 0 68 349.452 5 ↓
Mid Mid (pH 6-8) 1.87 8.48 -66.39 1 5 1 69 350.46 5 ↓

Analogs

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Popular Name: 4-[[methyl-[(1R)-1-methyl-2-methylsulfonyl-ethyl]amino]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2 4-[[methyl-[(1R)-1-methyl-2-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) 1.87 7.38 -17.41 0 5 0 68 349.452 5 ↓
Mid Mid (pH 6-8) 1.87 8.98 -56.79 1 5 1 69 350.46 5 ↓

Analogs

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Popular Name: 2-[2-[(2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methylamino]phenyl]sulfanylacetamide 2-[2-[(2-oxo-7,8-dihydro-6H-cycl…

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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) 2.71 8.41 -17.26 3 5 0 85 380.469 6 ↓

Analogs

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Popular Name: 4-[[5-(3-thienyl)tetrazol-2-yl]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[5-(3-thienyl)tetrazol-2-yl]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) 3.02 9.9 -13.35 0 6 0 74 350.403 3 ↓

Parameters Provided:

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filter.purchasability = annotated
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