UCSF

ZINC08782196

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 18 Yes

Other Names:

MFCD03848487

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) 2.02 -6.16 -12.89 1 4 0 63 299.398 3

Vendor Notes

Note Type Comments Provided By
melting_point 214 KeyOrganics

Activity (Go SEA)

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