UCSF

ZINC25499788

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 29 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) 3.89 10.44 -57.02 3 10 -1 164 395.351 6
Mid Mid (pH 6-8) 3.89 9.28 -144.68 2 10 -2 167 394.343 6

Activity (Go SEA)

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