UCSF

ZINC20238541

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 33 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) 4.02 9.15 -56.83 0 10 -1 143 511.264 5
Lo Low (pH 4.5-6) 3.56 10.93 -19.31 1 10 0 140 512.272 5

Activity (Go SEA)

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