UCSF

ZINC23092676

Substance Information

In ZINC since Heavy atoms Benign functionality
December 25th, 2008 20 Yes

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Annotations

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) 0.61 5.13 -79.75 3 5 2 41 284.448 5
Hi High (pH 8-9.5) 0.61 0.52 -10.17 1 5 0 39 282.432 5
Mid Mid (pH 6-8) 0.61 5 -90.1 3 5 2 41 284.448 5
Mid Mid (pH 6-8) 0.61 2.66 -35.7 2 5 1 40 283.44 5

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