UCSF

ZINC05751225

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 26 No

CAS Number: 10573-17-8

Download: MOL2 SDF SMILES Flexibase

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) 6.55 2.58 -45.71 0 2 -1 40 359.574 4

Vendor Notes

Note Type Comments Provided By
Patent Database Links US2007232576; US2007254859; WO2007096431; WO2007110003 ChEBI

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