UCSF

ZINC00740065

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 35 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) 4.30 9.97 -13.31 2 7 0 74 472.589 8
Lo Low (pH 4.5-6) 4.30 11.69 -49.6 3 7 1 75 473.597 8

Activity (Go SEA)

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