UCSF

ZINC06095165

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2006 22 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 5.20 8.77 -9.66 1 3 0 41 301.43 3
Hi High (pH 8-9.5) 5.20 9.8 -60.83 0 3 -1 43 300.422 3

Activity (Go SEA)

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