UCSF

ZINC03116716

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 29 Yes

Other Names:

MFCD00172730

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) 4.38 -0.41 -46.01 0 2 1 36 390.482 4

Vendor Notes

Note Type Comments Provided By
melting_point 197 - 199 KeyOrganics

Activity (Go SEA)

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