UCSF

ZINC19286189

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 31 Yes

Download: MOL2 SDF SMILES Flexibase

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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) 3.52 14.62 -101.28 2 5 2 38 421.633 4
Hi High (pH 8-9.5) 3.52 12.27 -41.76 1 5 1 37 420.625 4
Mid Mid (pH 6-8) 3.52 14.99 -177.99 3 5 3 39 422.641 4
Mid Mid (pH 6-8) 3.52 12.65 -82.15 2 5 2 38 421.633 4

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