UCSF

ZINC06240361

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2006 22 Yes

Other Names:

MFCD02186800

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) 3.85 8 -9.13 1 3 0 42 312.369 4

Vendor Notes

Note Type Comments Provided By
melting_point 110 - 111 KeyOrganics

Activity (Go SEA)

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