UCSF

ZINC51591596

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2010 22 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) 1.23 8.64 -39.42 1 7 1 80 308.358 6
Hi High (pH 8-9.5) 1.23 6.42 -15.2 0 7 0 79 307.35 6

Activity (Go SEA)

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