UCSF

ZINC95921742

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2014 21 No

Other Names:

MFCD26383438

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) 1.74 2.84 -26.45 3 6 0 88 286.287 4
Hi High (pH 8-9.5) 1.74 4.06 -69.59 2 6 -1 90 285.279 4

Vendor Notes

Note Type Comments Provided By
Indications epigenetic KeyOrganics Bioactives

Activity (Go SEA)

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

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