UCSF

ZINC36357366

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 19 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) 2.80 2.49 -10.13 3 4 0 72 342.193 1
Ref Reference (pH 7) 2.61 4.94 -8.89 3 4 0 68 342.193 1

Activity (Go SEA)

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