UCSF

ZINC04051738

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 19 No

Other Names:

MFCD04124961

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) -0.14 7.46 -57.37 0 7 -1 113 260.229 3

Vendor Notes

Note Type Comments Provided By
melting_point 188 - 190 KeyOrganics

Activity (Go SEA)

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