UCSF

ZINC15936883

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 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) 0.67 5.68 -25.91 1 11 0 154 488.503 7
Lo Low (pH 4.5-6) 0.67 5.59 -123.17 3 11 2 157 490.519 7

Activity (Go SEA)

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