UCSF

ZINC63866935

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2011 16 Yes

Other Names:

MFCD00005658

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.19 5.85 -92.14 2 3 2 28 220.316 4
Hi High (pH 8-9.5) 2.19 3.36 -30.99 1 3 1 26 219.308 4

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

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