UCSF

ZINC95936333

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2014 19 No

Other Names:

MFCD16295048

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) 1.93 5.59 -48.02 2 4 1 46 330.246 4
Hi High (pH 8-9.5) 1.93 4.25 -4.84 1 4 0 42 329.238 4

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

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