UCSF

ZINC15920305

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 35 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) 3.51 8.24 -57.72 1 7 -1 99 476.48 8
Lo Low (pH 4.5-6) 3.51 7.5 -17.45 2 7 0 96 477.488 8

Activity (Go SEA)

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