UCSF

ZINC44842413

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2010 14 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) -1.09 0.99 -21.01 3 5 0 81 218.278 6

Activity (Go SEA)

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