UCSF

ZINC41514099

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 31 No

Popular Name: (2Z)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-4-methyl-2-[(E)-3-phenylprop-2-enylidene (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) 3.32 6.58 -43.19 3 6 1 78 421.517 6 ↓
Hi High (pH 8-9.5) 3.32 4.88 -47.5 1 6 -1 80 419.501 6 ↓
Mid Mid (pH 6-8) 3.32 6.64 -41.9 3 6 1 78 421.517 6 ↓
Mid Mid (pH 6-8) 3.32 4.31 -10.97 2 6 0 77 420.509 6 ↓
Mid Mid (pH 6-8) 3.32 7.16 -31.01 2 6 0 81 420.509 6 ↓

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