UCSF

ZINC29563498

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2009 14 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) -2.56 -3.37 -53.05 5 6 1 103 200.218 2
Hi High (pH 8-9.5) -2.56 -3.7 -18.38 4 6 0 101 199.21 2

Activity (Go SEA)

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