UCSF

ZINC01401663

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 29 Yes

Other Names:

MFCD00215435

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) 5.05 -1.06 -10.22 1 4 0 54 399.881 5

Vendor Notes

Note Type Comments Provided By
melting_point 212 - 214 KeyOrganics

Activity (Go SEA)

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