UCSF

ZINC08782186

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 32 Yes

Other Names:

MFCD04125184

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) 6.23 0.83 -15.95 1 4 0 46 431.555 4

Vendor Notes

Note Type Comments Provided By
melting_point 234 - 235 KeyOrganics

Activity (Go SEA)

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