UCSF

ZINC16975826

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 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) 3.10 7.83 -12.25 1 4 0 59 272.691 2
Hi High (pH 8-9.5) 3.10 7.14 -47.99 0 4 -1 57 271.683 2

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

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