UCSF

ZINC41514117

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 33 No

Popular Name: (2Z)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-4-methyl-2-[(1-methylindol-3-yl)methylen (2Z)-6-hydroxy-7-[[4-(2-hydroxye…

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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 7.03 -50.93 3 7 1 83 448.543 5 ↓
Hi High (pH 8-9.5) 2.79 5.32 -49.21 1 7 -1 85 446.527 5 ↓
Mid Mid (pH 6-8) 2.79 4.74 -12.97 2 7 0 82 447.535 5 ↓
Mid Mid (pH 6-8) 2.79 7.59 -37.75 2 7 0 86 447.535 5 ↓
Mid Mid (pH 6-8) 2.79 7.08 -46.95 3 7 1 83 448.543 5 ↓

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