UCSF

ZINC62937081

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2011 19 No

Download: MOL2 SDF SMILES Flexibase

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) -0.26 6.6 -45.73 1 6 0 82 268.313 5
Hi High (pH 8-9.5) -0.26 4.05 -55.78 0 6 -1 81 267.305 5

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

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