UCSF

ZINC03049035

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 21 No

Other Names:

MFCD00664722

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) 2.36 8.45 -18.15 0 5 0 50 331.199 4

Vendor Notes

Note Type Comments Provided By
melting_point 0 KeyOrganics

Activity (Go SEA)

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

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