UCSF

ZINC13397395

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 15 No

Other Names:

MFCD02187160

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) 1.00 4.05 -11.26 0 5 0 65 214.217 4

Vendor Notes

Note Type Comments Provided By
melting_point 48 - 50 KeyOrganics

Activity (Go SEA)

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