UCSF

ZINC04041279

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 22 No

Other Names:

MFCD00974188

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) 3.88 0.86 -7.69 0 3 0 29 293.366 2

Vendor Notes

Note Type Comments Provided By
melting_point 87 - 89 KeyOrganics

Activity (Go SEA)

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