UCSF

ZINC13524368

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 32 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) 2.10 2.4 -87.37 4 8 0 136 480.608 13
Hi High (pH 8-9.5) 2.10 1.07 -53.61 3 8 -1 132 479.6 13

Activity (Go SEA)

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