UCSF

ZINC41697485

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 18 No

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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) 4.13 8.43 -8.1 1 2 0 29 310.235 4

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0468971A1; EP0543858A1; EP0543858B1; EP0543861A1; EP0543861B1; EP0580637A1; EP0635018A1; EP0635018B1; US5180723; US5180724; US5200412; US5223539; US5274094; US5276153; US5314880; US5451676; US5516783; WO1993016075A1 IBM Patent Data

Activity (Go SEA)

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