UCSF

ZINC23529032

Substance Information

In ZINC since Heavy atoms Benign functionality
January 3rd, 2009 14 Yes

Other Names:

MFCD09834628

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) 0.87 6.06 -30.59 3 3 1 45 192.217 1
Mid Mid (pH 6-8) 0.87 5.62 -10.03 2 3 0 44 191.209 1

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

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