UCSF

ZINC10512086

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 29 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) 3.41 -3.2 -49.57 1 8 -1 113 440.881 10
Hi High (pH 8-9.5) 3.41 -2.76 -120.82 0 8 -2 116 439.873 10

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

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