UCSF

ZINC33833336

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 33 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) -0.68 -10.21 -15.85 8 12 0 207 466.395 4
Hi High (pH 8-9.5) -0.68 -9.22 -56.5 7 12 -1 209 465.387 4

Activity (Go SEA)

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