UCSF

ZINC08309334

Substance Information

In ZINC since Heavy atoms Benign functionality
July 8th, 2006 21 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) 1.60 5.31 -53.42 3 6 1 86 289.359 7
Hi High (pH 8-9.5) 1.60 3.31 -23.64 2 6 0 85 288.351 7

Activity (Go SEA)

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