UCSF

ZINC08855270

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2007 30 No

Other Names:

MFCD00244791

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) 4.41 11.72 -9.06 0 5 0 50 418.88 4

Vendor Notes

Note Type Comments Provided By
melting_point 145 - 148 KeyOrganics

Activity (Go SEA)

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