UCSF

ZINC59782663

Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2011 22 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) 7.46 13.49 -39 2 3 1 43 314.534 18
Mid Mid (pH 6-8) 7.46 12.05 -4.33 1 3 0 38 313.526 18

Activity (Go SEA)

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