UCSF

ZINC07415683

Substance Information

In ZINC since Heavy atoms Benign functionality
May 28th, 2006 30 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) 4.82 13.38 -21.04 1 4 0 47 411.53 5
Mid Mid (pH 6-8) 4.82 13.81 -34.65 2 4 1 48 412.538 5

Activity (Go SEA)

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