UCSF

ZINC34475703

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 36 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 4.75 12.97 -17.75 4 6 0 88 488.517 7
Lo Low (pH 4.5-6) 4.75 13.14 -49.11 5 6 1 89 489.525 7

Activity (Go SEA)

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