UCSF

ZINC04072874

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2005 26 No

Other Names:

MFCD03787058

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) 3.91 5.33 -14.85 0 7 0 98 357.362 8

Vendor Notes

Note Type Comments Provided By
melting_point 99 - 101 KeyOrganics

Activity (Go SEA)

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