UCSF

ZINC42676250

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2010 18 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) 0.95 3.01 -10.78 1 6 0 76 278.374 7
Hi High (pH 8-9.5) 0.95 2.72 -45.23 0 6 -1 78 277.366 7

Activity (Go SEA)

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