UCSF

ZINC36167518

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 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) 0.70 2.28 -60.31 2 5 1 69 284.357 3
Hi High (pH 8-9.5) 0.70 1.11 -14.62 1 5 0 65 283.349 3

Activity (Go SEA)

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