UCSF

ZINC22917948

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 16 Yes

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) 4.00 8.36 -31.82 1 2 1 8 229.432 11
Mid Mid (pH 6-8) 4.00 10.52 -105.65 2 2 2 9 230.44 11

Activity (Go SEA)

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