UCSF

ZINC05860106

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 22 Yes

Other Names:

MFCD03305833

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) 5.44 0.97 -7.31 1 3 0 38 303.446 7

Vendor Notes

Note Type Comments Provided By
melting_point 103 - 105 KeyOrganics

Activity (Go SEA)

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