UCSF

ZINC19885125

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 32 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) 3.70 8.08 -54.1 0 6 -1 73 478.327 6
Mid Mid (pH 6-8) 3.70 10.42 -73.61 1 6 0 74 479.335 6

Activity (Go SEA)

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