UCSF

ZINC44623505

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2010 19 No

Download: MOL2 SDF SMILES Flexibase

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) -1.00 7.05 -28.61 1 6 0 82 270.329 6
Hi High (pH 8-9.5) -1.00 4.73 -50.4 0 6 -1 81 269.321 6

Activity (Go SEA)

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