UCSF

ZINC69227737

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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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) 3.21 10.12 -36.67 1 6 1 63 356.446 6
Hi High (pH 8-9.5) 3.21 7.9 -10.11 0 6 0 62 355.438 6

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

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