UCSF

ZINC15670680

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2008 28 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) 2.47 10.52 -7.99 1 6 0 73 393.468 1
Hi High (pH 8-9.5) 2.82 10.49 -37.25 1 6 -1 79 392.46 2

Activity (Go SEA)

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