UCSF

ZINC06184726

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2006 19 Yes

Other Names:

MFCD02187419

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) 0.95 -3.18 -8.48 0 5 0 49 260.341 2

Vendor Notes

Note Type Comments Provided By
melting_point 135 - 137 KeyOrganics

Activity (Go SEA)

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