UCSF

ZINC15924134

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 19 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) 1.53 4.51 -19.82 2 8 0 116 279.281 4
Lo Low (pH 4.5-6) 1.53 5.03 -50.68 3 8 1 117 280.289 4

Activity (Go SEA)

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