UCSF

ZINC54747282

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2010 17 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) -0.98 1.22 -62.12 2 7 1 94 260.343 7
Hi High (pH 8-9.5) -0.98 -0.06 -24.54 1 7 0 90 259.335 7

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

No pre-computed analogs available. Try a structural similarity search.