UCSF

ZINC95748833

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2014 16 No

Other Names:

MFCD06739000

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) 0.79 4.64 -43.59 2 3 1 42 220.271 1
Hi High (pH 8-9.5) 0.79 3.29 -13.22 1 3 0 38 219.263 1

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

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