UCSF

ZINC19685625

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2008 19 Yes

Download: MOL2 SDF SMILES Flexibase

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) 0.61 1.6 -57.32 4 5 1 85 287.405 6
Hi High (pH 8-9.5) 0.61 1.22 -12.4 3 5 0 84 286.397 6

Activity (Go SEA)

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