UCSF

ZINC60194599

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2011 39 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) 5.08 19.14 -17.77 0 10 0 119 528.565 11
Lo Low (pH 4.5-6) 5.08 19.65 -47.06 1 10 1 121 529.573 11

Activity (Go SEA)

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