UCSF

ZINC62038489

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 33 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 5.73 6.85 -21.23 3 7 0 104 481.599 7
Hi High (pH 8-9.5) 6.19 5.53 -53.92 2 7 -1 107 480.591 7

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

No pre-computed analogs available. Try a structural similarity search.