UCSF

ZINC33855551

Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2009 34 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) 3.40 11.86 -30.76 1 10 0 124 500.968 6
Hi High (pH 8-9.5) 3.59 8.9 -66.39 0 10 -1 131 499.96 6

Activity (Go SEA)

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