UCSF

ZINC01384426

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2005 26 Yes

Other Names:

MFCD03787552

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.35 -2.38 -46.51 2 9 1 99 358.426 5

Vendor Notes

Note Type Comments Provided By
melting_point 192 - 193 KeyOrganics

Activity (Go SEA)

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

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