UCSF

ZINC43211838

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 28 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) 1.91 10.57 -34.26 2 6 0 94 406.91 7
Hi High (pH 8-9.5) 1.91 9.65 -44.98 1 6 -1 90 405.902 7

Activity (Go SEA)

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