UCSF

ZINC18213318

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2008 30 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) 3.72 8.56 -14.17 1 6 0 79 438.53 4
Ref Reference (pH 7) 3.72 8.72 -10.79 1 6 0 79 438.53 4

Activity (Go SEA)

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