UCSF

ZINC26319523

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 25 No

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) 2.89 3.87 -15.75 1 7 0 93 384.479 7
Mid Mid (pH 6-8) 2.89 3.94 -41.91 0 7 -1 95 383.471 7

Activity (Go SEA)

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