UCSF

ZINC01392905

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 23 No

Other Names:

MFCD02082054

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) 3.36 11.73 -21.51 0 2 0 34 316.347 6

Vendor Notes

Note Type Comments Provided By
melting_point 90 - 92 KeyOrganics

Activity (Go SEA)

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