UCSF

ZINC07760339

Substance Information

In ZINC since Heavy atoms Benign functionality
June 15th, 2006 24 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) 0.38 9.17 -39.13 0 4 0 49 345.512 3
Mid Mid (pH 6-8) -0.08 12.22 -48.43 1 4 1 46 346.52 3

Activity (Go SEA)

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