UCSF

ZINC31703885

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2009 24 No

Popular Name: 1-Piperazineethanol, 4,4'-(dithiodicarbonothioyl)bis-; BRN 0847046; Bis((4-(2-hydroxyethyl)-1-piperazinyl)thiocarbonyl)disulfide; Disulfide, bis((4-(2-hydroxyethyl)-1-piperazinyl)thiocarbonyl); Ewp 840; LS-63055 1-Piperazineethanol, 4,4'-(dithi…

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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) 0.73 0.15 -16.8 2 6 0 53 410.656 9 ↓
Mid Mid (pH 6-8) 0.73 2.51 -50.4 3 6 1 55 411.664 9 ↓

Activity (Go SEA)

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