UCSF

ZINC64246470

Substance Information

In ZINC since Heavy atoms Benign functionality
June 15th, 2011 24 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) 2.16 9.81 -41.61 1 5 1 45 375.32 8
Hi High (pH 8-9.5) 2.16 7.87 -14.32 0 5 0 44 374.312 8

Activity (Go SEA)

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