UCSF

ZINC08743702

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 21 Yes

Other Names:

MFCD01315866

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) 2.65 -2.39 -32.79 2 5 1 58 304.395 3

Vendor Notes

Note Type Comments Provided By
melting_point 136 - 138 KeyOrganics

Activity (Go SEA)

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

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