UCSF

ZINC01391415

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 16 Yes

Other Names:

MFCD00232780

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) -0.56 2.89 -14.39 2 7 0 100 221.22 3

Vendor Notes

Note Type Comments Provided By
melting_point 141 - 144 KeyOrganics

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.