UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-(2H-chromen-3-ylmethylene)-1-ethyl-4-methyl-2,6-dioxo-pyridine-3-carbonitrile 5-(2H-chromen-3-ylmethylene)-1-e…

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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) 2.46 9.27 -19.58 0 5 0 72 320.348 2 ↓

Analogs

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Popular Name: 3-(6-chloro-2H-chromen-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]prop-2-enamide 3-(6-chloro-2H-chromen-3-yl)-N-[…

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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) 3.62 -0.1 -12.46 1 5 0 56 391.858 5 ↓

Analogs

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Popular Name: 6-chloro-N-[(1-phenylpyrazol-4-yl)methyl]-2H-chromene-3-carboxamide 6-chloro-N-[(1-phenylpyrazol-4-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.10 -0.21 -11.44 1 5 0 56 365.82 4 ↓

Analogs

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Popular Name: 6-bromo-N-(8-quinolyl)-2H-chromene-3-carboxamide 6-bromo-N-(8-quinolyl)-2H-chrome…

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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) 3.84 -1.5 -10.49 1 4 0 51 381.229 2 ↓

Analogs

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Popular Name: N-[2-(5-bromo-2-thienyl)ethyl]-2H-chromene-3-carboxamide N-[2-(5-bromo-2-thienyl)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) 4.03 -2.49 -11.05 1 3 0 38 364.264 4 ↓

Analogs

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Popular Name: 6-bromo-N-[(7-chloro-4-oxo-3H-quinazolin-2-yl)methyl]-N-propyl-2H-chromene-3-carboxamide 6-bromo-N-[(7-chloro-4-oxo-3H-qu…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.51 -1.6 -14.36 1 6 0 75 488.769 5 ↓

Analogs

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Popular Name: (6-methoxy-2H-chromen-4-yl)methanamine (6-methoxy-2H-chromen-4-yl)metha…

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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) 0.88 2.2 -49.84 3 3 1 46 192.238 2 ↓

Analogs

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Popular Name: 6-(3-pyridylmethyl)-2H-chromene-3-carbaldehyde 6-(3-pyridylmethyl)-2H-chromene-…

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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) 2.81 7.4 -12.64 0 3 0 39 251.285 3 ↓

Analogs

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Popular Name: N-[[6-(3-pyridylmethyl)-2H-chromen-3-yl]methyl]hydroxylamine N-[[6-(3-pyridylmethyl)-2H-chrom…

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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) 2.46 4.12 -9.07 2 4 0 54 268.316 4 ↓

Analogs

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Popular Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-2H-chromene-3-car N-[(4-chloro-1-methyl-pyrazol-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) 2.56 9.6 -15.85 0 7 0 65 425.92 5 ↓

Analogs

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Popular Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-(2-pyrrolidin-1-ylethyl)-2H-chromene-3-carboxamide N-[(4-chloro-1-methyl-pyrazol-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) 2.77 10.38 -45.89 1 6 1 52 401.918 6 ↓

Analogs

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Popular Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-(2-morpholinoethyl)-2H-chromene-3-carboxamide N-[(4-chloro-1-methyl-pyrazol-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) 2.21 6.17 -11.99 0 7 0 60 416.909 6 ↓
Mid Mid (pH 6-8) 2.21 8.43 -48.96 1 7 1 61 417.917 6 ↓

Analogs

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Popular Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-N-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl]-2H-chromen N-[(2-chloro-4-fluoro-phenyl)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) 4.60 14.04 -15.77 0 6 0 56 517.988 6 ↓

Analogs

35497481
35497481

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Popular Name: N-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-N-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl] N-[[(4R)-2,2-dimethyl-1,3-dioxol…

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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) 3.04 11.58 -16.47 0 8 0 75 489.572 6 ↓

Analogs

35497478
35497478

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Popular Name: N-[[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]-N-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl] N-[[(4S)-2,2-dimethyl-1,3-dioxol…

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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) 3.04 11.5 -17.6 0 8 0 75 489.572 6 ↓

Analogs

35497498
35497498

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Popular Name: N-[[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]methyl]-N-(2-morpholinoethyl)-2H-chromene-3-carboxamide N-[[(1R,4R,5R)-5-bicyclo[2.2.1]h…

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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 8.68 -9.78 0 5 0 42 394.515 6 ↓
Mid Mid (pH 6-8) 3.41 10.96 -50.36 1 5 1 43 395.523 6 ↓

Analogs

35497496
35497496

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Popular Name: N-[[(1R,4R,5S)-5-bicyclo[2.2.1]hept-2-enyl]methyl]-N-(2-morpholinoethyl)-2H-chromene-3-carboxamide N-[[(1R,4R,5S)-5-bicyclo[2.2.1]h…

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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 8.73 -9.11 0 5 0 42 394.515 6 ↓
Mid Mid (pH 6-8) 3.41 11.01 -46.7 1 5 1 43 395.523 6 ↓

Analogs

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Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]-2H-chromene-3-carboxamide N-(1,3-benzodioxol-5-ylmethyl)-N…

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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 9.79 -48.69 1 7 1 67 404.446 5 ↓
Mid Mid (pH 6-8) 2.49 9.82 -11.55 0 7 0 66 403.438 5 ↓

Analogs

35497521
35497521

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Popular Name: N-[(1-methylimidazol-2-yl)methyl]-N-[(1R)-tetralin-1-yl]-2H-chromene-3-carboxamide N-[(1-methylimidazol-2-yl)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) 3.57 13.23 -43.92 1 5 1 49 400.502 4 ↓
Mid Mid (pH 6-8) 3.57 11.99 -13.82 0 5 0 47 399.494 4 ↓

Analogs

35497519
35497519

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Popular Name: N-[(1-methylimidazol-2-yl)methyl]-N-[(1S)-tetralin-1-yl]-2H-chromene-3-carboxamide N-[(1-methylimidazol-2-yl)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) 3.57 13.06 -43.53 1 5 1 49 400.502 4 ↓
Mid Mid (pH 6-8) 3.57 12.63 -15.73 0 5 0 47 399.494 4 ↓

Analogs

35497550
35497550

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Popular Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-2H-chromene-3-car N-[(4-chloro-1-methyl-pyrazol-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) 3.13 10.85 -41.14 1 6 1 52 415.945 6 ↓

Analogs

35497548
35497548

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Popular Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2H-chromene-3-car N-[(4-chloro-1-methyl-pyrazol-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) 3.13 11.27 -34.55 1 6 1 52 415.945 6 ↓

Analogs

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Popular Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(2-pyrrolidin-1-ylethyl)-2H-chromene-3-carboxamide N-(1,3-benzodioxol-4-ylmethyl)-N…

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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) 3.34 10.74 -44.11 1 6 1 52 407.49 6 ↓

Analogs

35497591
35497591

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Popular Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]-2H-chromene-3-ca N-[[(3R)-2,3-dihydro-1,4-benzodi…

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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) 2.35 10.98 -41.34 1 7 1 67 418.473 5 ↓
Mid Mid (pH 6-8) 2.35 10.31 -22.46 0 7 0 66 417.465 5 ↓

Analogs

35497589
35497589

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Popular Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-[(1-methylimidazol-2-yl)methyl]-2H-chromene-3-ca N-[[(3S)-2,3-dihydro-1,4-benzodi…

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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) 2.35 10.7 -37.18 1 7 1 67 418.473 5 ↓
Mid Mid (pH 6-8) 2.35 10.57 -13.91 0 7 0 66 417.465 5 ↓

Analogs

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Popular Name: 8-ethoxy-N-(2-methylsulfonylethyl)-2H-chromene-3-carboxamide 8-ethoxy-N-(2-methylsulfonylethy…

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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) 0.99 2.44 -23.8 1 6 0 82 325.386 6 ↓

Analogs

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Popular Name: 6-chloro-N-methyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-2H-chromene-3-carboxamide 6-chloro-N-methyl-N-[2-[(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) 2.30 6.99 -15.37 1 7 0 85 361.785 4 ↓

Analogs

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Popular Name: N-allyl-2-[4-(6-chloro-2H-chromene-3-carbonyl)piperazin-1-yl]acetamide N-allyl-2-[4-(6-chloro-2H-chrome…

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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 5.07 -12.5 1 6 0 62 375.856 5 ↓

Analogs

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Popular Name: (2R)-2-[(E)-4,8-dimethyl-6-oxo-non-3-enyl]-5-hydroxy-2,7-dimethyl-chromene-6-carboxylic (2R)-2-[(E)-4,8-dimethyl-6-oxo-n…

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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) 5.36 11.11 -58.66 1 5 -1 87 385.48 8 ↓

Analogs

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Popular Name: (2S)-2-[(E)-4,8-dimethyl-6-oxo-non-3-enyl]-5-hydroxy-2,7-dimethyl-chromene-6-carboxylic (2S)-2-[(E)-4,8-dimethyl-6-oxo-n…

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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) 5.36 11.11 -57.7 1 5 -1 87 385.48 8 ↓

Analogs

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Popular Name: cyclopentyl-(8-methoxy-2H-chromen-3-yl)BLAHone cyclopentyl-(8-methoxy-2H-chrome…

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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) 4.59 0.09 -40.33 1 5 1 43 395.523 3 ↓

Analogs

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Popular Name: [1-[(6-chloro-2H-chromen-3-yl)methyl]-4-(2-phenoxyethyl)-4-piperidyl]methanol [1-[(6-chloro-2H-chromen-3-yl)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) 4.77 10.11 -47.2 2 4 1 43 414.953 7 ↓
Hi High (pH 8-9.5) 4.77 7.94 -7.88 1 4 0 42 413.945 7 ↓

Analogs

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Popular Name: N-[(1S)-2-amino-1-methyl-2-oxo-ethyl]-6-chloro-2H-chromene-3-carboxamide N-[(1S)-2-amino-1-methyl-2-oxo-e…

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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) 1.68 1.65 -10.02 3 5 0 81 280.711 3 ↓

Analogs

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Popular Name: N-[(1R)-2-amino-1-methyl-2-oxo-ethyl]-6-chloro-2H-chromene-3-carboxamide N-[(1R)-2-amino-1-methyl-2-oxo-e…

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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) 1.68 1.65 -10.17 3 5 0 81 280.711 3 ↓

Analogs

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Popular Name: 1-[(2S)-6-chloro-2-morpholino-8-nitro-2H-chromen-3-yl]-2-methyl-propan-1-one 1-[(2S)-6-chloro-2-morpholino-8-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.98 6.59 -14.39 0 7 0 85 366.801 4 ↓

Analogs

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Popular Name: 1-[(2R)-6-chloro-2-morpholino-8-nitro-2H-chromen-3-yl]-2-methyl-propan-1-one 1-[(2R)-6-chloro-2-morpholino-8-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.98 6.76 -10.08 0 7 0 85 366.801 4 ↓

Analogs

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Popular Name: (6-methoxy-2H-chromen-3-yl)-phenethyl-BLAHone (6-methoxy-2H-chromen-3-yl)-phen…

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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) 5.22 0.2 -39.94 1 5 1 43 431.556 5 ↓

Analogs

11843585
11843585

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Popular Name: 3-[(3S)-1-[(8-methoxy-2H-chromen-3-yl)methyl]-3-piperidyl]-N-(4-methoxy-2-methyl-phenyl)propanamide 3-[(3S)-1-[(8-methoxy-2H-chromen…

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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) 4.68 0.99 -50.44 2 6 1 61 451.587 8 ↓

Analogs

11843584
11843584

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Popular Name: 3-[(3R)-1-[(8-methoxy-2H-chromen-3-yl)methyl]-3-piperidyl]-N-(4-methoxy-2-methyl-phenyl)propanamide 3-[(3R)-1-[(8-methoxy-2H-chromen…

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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) 4.68 0.86 -53.45 2 6 1 61 451.587 8 ↓

Analogs

37860541
37860541
37860900
37860900

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Popular Name: 6-chloro-N-cyclopropyl-N-(2-hydroxyethyl)-2H-chromene-3-carboxamide 6-chloro-N-cyclopropyl-N-(2-hydr…

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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) 2.03 4.61 -9.64 1 4 0 50 293.75 4 ↓

Analogs

37860494
37860494
37860855
37860855

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Popular Name: 6-bromo-N-cyclopropyl-N-(2-hydroxyethyl)-2H-chromene-3-carboxamide 6-bromo-N-cyclopropyl-N-(2-hydro…

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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) 2.16 4.72 -9.62 1 4 0 50 338.201 4 ↓

Analogs

20204342
20204342

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Popular Name: 1-[4-[3-[[(6-methoxy-2H-chromen-3-yl)methylamino]methyl]-2-pyridyl]piperazin-1-yl]ethanone 1-[4-[3-[[(6-methoxy-2H-chromen-…

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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) 1.92 -2.46 -122.8 3 7 2 73 410.518 6 ↓

Analogs

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Popular Name: N-[4-(4-fluorophenyl)-1-[(6-methoxy-2H-chromen-3-yl)methyl]-4-piperidyl]acetamide N-[4-(4-fluorophenyl)-1-[(6-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) 3.72 1.55 -58.29 2 5 1 52 411.497 5 ↓

Analogs

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Popular Name: N-[4-(2-fluorophenyl)-1-[(6-methoxy-2H-chromen-3-yl)methyl]-4-piperidyl]acetamide N-[4-(2-fluorophenyl)-1-[(6-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) 3.67 1.03 -50.98 2 5 1 52 411.497 5 ↓

Analogs

6355231
6355231
6582077
6582077

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Popular Name: (E)-3-(2H-chromen-3-yl)-2-cyano-N-(4-fluorophenyl)prop-2-enamide (E)-3-(2H-chromen-3-yl)-2-cyano-…

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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) 3.50 8.51 -9.75 1 4 0 62 320.323 3 ↓

Analogs

51358028
51358028

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Popular Name: 3-(2H-chromen-3-ylmethyleneamino)-2-thioxo-thiazolidin-4-one 3-(2H-chromen-3-ylmethyleneamino…

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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) 2.28 6.8 -16.13 0 4 0 42 290.369 2 ↓

Analogs

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Popular Name: 2-(2H-chromen-3-ylmethylene)indane-1,3-dione 2-(2H-chromen-3-ylmethylene)inda…

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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 9.32 -10.7 0 3 0 43 288.302 1 ↓

Analogs

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Popular Name: 2-[(6-chloro-2H-chromen-3-yl)methylene]indane-1,3-dione 2-[(6-chloro-2H-chromen-3-yl)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) 3.93 9.84 -9.68 0 3 0 43 322.747 1 ↓

Analogs

51358030
51358030

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Popular Name: 3-[(6-chloro-2H-chromen-3-yl)methyleneamino]-2-thioxo-thiazolidin-4-one 3-[(6-chloro-2H-chromen-3-yl)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) 2.93 7.32 -14.73 0 4 0 42 324.814 2 ↓

Analogs

12537940
12537940

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Popular Name: N-[(1R)-1-(2-pyridyl)ethyl]-2H-chromene-3-carboxamide N-[(1R)-1-(2-pyridyl)ethyl]-2H-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) 2.19 6.38 -9.32 1 4 0 51 280.327 3 ↓
Lo Low (pH 4.5-6) 2.19 6.72 -39.83 2 4 1 52 281.335 3 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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