UCSF

ZINC16611241

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2008 28 No

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Annotations

Vendors

    None

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) 2.16 5.74 -20.39 2 8 0 97 427.548 9
Hi High (pH 8-9.5) 2.16 5.82 -52.26 1 8 -1 99 426.54 9

Activity (Go SEA)

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