UCSF

ZINC16587115

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2008 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.34 6.27 -9.37 0 4 0 41 368.861 4
Lo Low (pH 4.5-6) 3.34 8.49 -50.12 1 4 1 42 369.869 4

Activity (Go SEA)

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