UCSF

ZINC79414292

Substance Information

In ZINC since Heavy atoms Benign functionality
October 19th, 2012 37 No

CAS Numbers: 6990-06-3 , [6990-06-3]

Annotations

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

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0573768B1 IBM Patent Data

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

No pre-computed analogs available. Try a structural similarity search.