UCSF

ZINC01506908

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 14 No

CAS Numbers: 118118-98-2 , 5796-17-8 , 59-92-7 , 63-84-3 , [5796-17-8] , [63-84-3]

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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) -2.20 -0.89 -36.41 5 5 0 108 197.19 3

Vendor Notes

Note Type Comments Provided By
Melting_Point 290? dec. Alfa-Aesar
Melting_Point 290° dec. Alfa-Aesar
UniProt Database Links 4F2_HUMAN; 4F2_MOUSE; 4F2_RABIT; 4F2_RAT; ACTB_HUMAN; CF1A_DROME; COMT_BOVIN; COMT_HORSE; COMT_HUMAN; COMT_MOUSE; COMT_PIG; COMT_RAT; DDC_BOVIN; DDC_CAEEL; DDC_CATRO; DDC_CAVPO; DDC_DROLE; DDC_DROME; DDC_DROSI; DDC_HUMAN; DDC_MANSE; DDC_MOUSE; DDC_PIG; DD ChEBI
Purity 95% Fluorochem
Patent Database Links EP1256343; EP1808169; EP1972615; GB2321455; US2001006962; US2003026850; US2003153544; US2003162832; US2004063677; US2004101523; US2004106117; US2004142904; US2004171682; US2005059608; US2005282831; US2005288347; US2006039962; US2006111373; US2006128731; U ChEBI

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