UCSF

ZINC22996527

Substance Information

In ZINC since Heavy atoms Benign functionality
December 23rd, 2008 20 Yes

Other Names:

MFCD11501764

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) 2.91 4.91 -5.33 1 3 0 42 298.186 4

Vendor Notes

Note Type Comments Provided By
melting_point 60 - 62 KeyOrganics

Activity (Go SEA)

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

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