UCSF

ZINC24381257

Substance Information

In ZINC since Heavy atoms Benign functionality
January 16th, 2009 25 Yes

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) 1.73 7.21 -23.7 2 6 0 76 344.321 4
Lo Low (pH 4.5-6) 1.73 7.64 -55.6 3 6 1 77 345.329 4

Activity (Go SEA)

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