UCSF

ZINC06361933

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2006 17 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) 1.19 -4.69 -13.94 2 5 0 75 256.327 5
Hi High (pH 8-9.5) 1.19 -4.26 -48.28 1 5 -1 77 255.319 5

Activity (Go SEA)

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