UCSF

ZINC13281760

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 18 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) 2.28 6.95 -12.39 0 6 0 76 240.222 2
Mid Mid (pH 6-8) 2.28 7.35 -49.41 1 6 1 77 241.23 2

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

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