UCSF

ZINC38584318

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 33 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) 6.22 14.44 -16.19 1 5 0 56 447.623 10
Mid Mid (pH 6-8) 6.22 14.73 -39.14 2 5 1 57 448.631 10

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

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