UCSF

ZINC16246734

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2008 31 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) 1.31 2.7 -104.19 1 10 -2 154 444.783 6
Hi High (pH 8-9.5) 1.31 3.48 -160.25 0 10 -3 157 443.775 6

Activity (Go SEA)

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