UCSF

ZINC63720306

Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 18 No

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Annotations

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Vendors

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) 2.10 4.44 -40.82 0 5 -1 58 257.298 1
Mid Mid (pH 6-8) 2.10 3.9 -6.64 0 5 0 58 258.306 1

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

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