UCSF

ZINC12338586

Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2008 34 No

Other Names:

MFCD01936362

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) 2.22 0.82 -30.32 4 10 0 135 482.518 12

Vendor Notes

Note Type Comments Provided By
melting_point 270 - 272 KeyOrganics

Activity (Go SEA)

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

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