UCSF

ZINC00480526

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 21 Yes

Other Names:

MFCD05155635

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) 2.52 4.47 -53.11 1 6 -1 88 306.319 5
Mid Mid (pH 6-8) 2.52 3.59 -10.7 2 6 0 85 307.327 5

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

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