UCSF

ZINC95863249

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 17 Yes

Other Names:

MFCD04114284

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) 2.86 8.92 -41.32 1 2 1 17 231.363 4
Hi High (pH 8-9.5) 2.86 6.42 -4.62 0 2 0 16 230.355 4

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

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