UCSF

ZINC86860248

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2013 13 No

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Annotations

None

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) 0.84 4.82 -60.87 0 4 -1 62 178.167 4
Mid Mid (pH 6-8) 0.84 4.21 -11.6 1 4 0 59 179.175 4

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

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