UCSF

ZINC31560904

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 21 No

Popular Name: 1-Piperazinecarbodithioic acid, 4-((2,6-xylylcarbamoyl)methyl)-, monosodium salt, hydrate; 4-((2,6-Xylylcarbamoyl)methyl)-1-piperazinecarbodithioic acid sodium salt hydrate; LS-110633 1-Piperazinecarbodithioic acid, …

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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) 2.00 6.6 -46.04 1 4 -1 36 322.479 4 ↓
Lo Low (pH 4.5-6) 2.00 8.76 -60.28 2 4 0 37 323.487 4 ↓

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