UCSF

ZINC65530647

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 19 No

Other Names:

MFCD01206380

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) 0.78 4.76 -57.16 1 5 1 59 289.421 6
Mid Mid (pH 6-8) 0.78 2.5 -18.02 0 5 0 58 288.413 6

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

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