UCSF

ZINC03125686

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 17 No

Other Names:

MFCD00202752

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) 0.59 2.05 -10.76 1 5 0 61 232.239 1

Vendor Notes

Note Type Comments Provided By
melting_point 102 - 106 KeyOrganics

Activity (Go SEA)

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