UCSF

ZINC19515142

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 16 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) 1.02 2.65 -16.73 3 4 0 60 237.328 4
Mid Mid (pH 6-8) 1.02 3.12 -48.03 4 4 1 61 238.336 4

Activity (Go SEA)

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