UCSF

ZINC06001887

Substance Information

In ZINC since Heavy atoms Benign functionality
February 22nd, 2006 34 No

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) 3.25 4.42 -56.31 1 8 1 76 470.542 8

Vendor Notes

Note Type Comments Provided By
melting_point 201 - 202 KeyOrganics

Activity (Go SEA)

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