UCSF

ZINC95891365

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2014 12 No

Other Names:

MFCD06657115

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) 0.72 2.1 -8.2 2 2 0 39 164.183 1
Lo Low (pH 4.5-6) 0.72 2.51 -46.26 3 2 1 41 165.191 1

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

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