UCSF

ZINC95884454

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2014 17 No

Other Names:

MFCD08743539

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) -0.34 3.9 -52.55 2 4 1 49 230.291 1
Mid Mid (pH 6-8) -0.34 2.59 -9 1 4 0 45 229.283 1

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

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