UCSF

ZINC10681895

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2007 31 Yes

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) 4.41 0.86 -61.49 1 8 -1 113 435.485 7

Activity (Go SEA)

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