UCSF

ZINC41055616

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2010 24 Yes

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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) 1.54 7.15 -15.62 2 5 0 79 324.311 3
Hi High (pH 8-9.5) 2.84 6.95 -48.23 1 5 -1 82 323.303 3

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

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