UCSF

ZINC37802084

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 20 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) -0.34 0.26 -53.74 3 6 1 91 307.436 7
Hi High (pH 8-9.5) -0.34 0.12 -15.67 2 6 0 90 306.428 7

Activity (Go SEA)

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