UCSF

ZINC31562082

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 34 Yes

Popular Name: 1,1'-(4,4'-Biphenylylenebis(carbonylmethylene))bis(4-hydroxy-1-methylpiperidinium bromide); LS-116327; Piperidinium, 1,1'-(4,4'-biphenylylenebis(carbonylmethylene))bis(4-hydroxy-1-methyl-, dibromide 1,1'-(4,4'-Biphenylylenebis(carb…

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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) 3.12 10.18 -94.64 4 6 2 83 466.622 9 ↓
Hi High (pH 8-9.5) 3.12 5.81 -15.73 2 6 0 81 464.606 9 ↓
Mid Mid (pH 6-8) 3.12 8 -51.58 3 6 1 82 465.614 9 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )