UCSF

ZINC37081267

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 11 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) 0.85 4.23 -34.42 2 2 1 16 173.305 3
Hi High (pH 8-9.5) 0.85 1.77 -2.67 1 2 0 15 172.297 3

Activity (Go SEA)

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