UCSF

ZINC36126623

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 24 No

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) -0.45 -2.75 -19.1 1 9 0 127 374.396 2
Hi High (pH 8-9.5) 0.00 -5.38 -52.5 0 9 -1 130 373.388 2

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

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