UCSF

ZINC43830135

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2010 21 Yes

Other Names:

MFCD16652933

Download: MOL2 SDF SMILES Flexibase

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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) 0.97 2.42 -11.19 1 7 0 85 295.339 4
Mid Mid (pH 6-8) 1.43 0.79 -45.81 0 7 -1 88 294.331 4

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

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