UCSF

ZINC02040905

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 10 Yes

CAS Number: 254-04-6

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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) 2.35 0.79 -4.61 0 1 0 9 132.162 0

Vendor Notes

Note Type Comments Provided By
Patent Database Links EP1281710; WO2005035491; WO2005042542 ChEBI

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