UCSF

ZINC95868060

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 15 Yes

Other Names:

MFCD03695471

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) 1.03 5.49 -46.99 2 2 1 29 199.277 1
Mid Mid (pH 6-8) 1.03 4.1 -5.67 1 2 0 24 198.269 1

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

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