UCSF

ZINC23381927

Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2008 17 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) -0.38 1.82 -18.59 2 5 0 64 272.399 3
Mid Mid (pH 6-8) -0.38 4.16 -45.76 3 5 1 65 273.407 3

Activity (Go SEA)

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