UCSF

ZINC49281489

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 18 No

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Annotations

Vendors

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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) -0.50 3.67 -29.36 0 6 0 51 268.342 3
Mid Mid (pH 6-8) -0.50 5.87 -68.5 1 6 1 52 269.35 3

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

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