UCSF

ZINC32793030

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2009 43 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) 9.15 21.86 -65.81 3 9 0 139 635.864 35
Hi High (pH 8-9.5) 9.15 21.47 -50.37 2 9 -1 137 634.856 35

Activity (Go SEA)

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