UCSF

ZINC34320168

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 15 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) 2.67 8.08 -41.1 1 2 1 8 270.194 3
Mid Mid (pH 6-8) 2.67 5.86 -3.21 0 2 0 6 269.186 3

Activity (Go SEA)

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