UCSF

ZINC03104898

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 22 Yes

Other Names:

MFCD00794099

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) 4.95 1.82 -5.15 0 3 0 49 305.768 2

Vendor Notes

Note Type Comments Provided By
melting_point 204 - 206 KeyOrganics

Activity (Go SEA)

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