UCSF

ZINC05298909

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 16 No

Popular Name: 1-Propanol, 2,3-dimercapto-, 1-p-anisate; 2,3-Dimercapto-1-propanol 1-p-anisate; BRL 651; BRN 2695405; LS-20089; p-Anisic acid, 2,3-dimercaptopropyl ester 1-Propanol, 2,3-dimercapto-, 1-p…

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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 6.46 -5.9 0 3 0 36 258.364 6 ↓
Hi High (pH 8-9.5) 2.79 7 -43 0 3 -1 36 257.356 6 ↓

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