UCSF

ZINC86864951

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2013 26 No

CAS Number: 27741-01-1

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Annotations

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Vendors

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) -2.15 -6.78 -52.97 5 10 -1 169 373.334 5
Lo Low (pH 4.5-6) -2.15 -8.69 -11.7 6 10 0 166 374.342 5

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