UCSF

ZINC00838490

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2005 28 Yes

Other Names:

MFCD00879955

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) 3.13 6.89 -13.69 3 7 0 87 375.432 6
Mid Mid (pH 6-8) 3.13 7.26 -29.57 4 7 1 88 376.44 6

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

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