UCSF

ZINC00160056

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 No

Download: MOL2 SDF SMILES Flexibase

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) 0.66 2.55 -8.72 3 4 0 64 166.209 1

Vendor Notes

Note Type Comments Provided By
MP 211 - 213 Enamine Building Blocks
MP 211...213 Enamine Building Blocks
melting_point 215 - 217 (dec) KeyOrganics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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

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