UCSF

ZINC39020428

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2010 18 No

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Annotations

Vendors

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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) 3.00 6.82 -8.32 1 3 0 46 239.274 4
Hi High (pH 8-9.5) 2.00 7.36 -51.54 1 3 -1 52 238.266 3

Activity (Go SEA)

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