UCSF

ZINC64915434

Substance Information

In ZINC since Heavy atoms Benign functionality
June 28th, 2011 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 2.64 5 -15.04 3 8 0 121 378.454 9
Lo Low (pH 4.5-6) 2.64 5.43 -83.96 4 8 0 122 379.462 9

Activity (Go SEA)

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