UCSF

ZINC11985975

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2008 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.34 9.39 -13.38 1 9 0 134 362.367 4
Hi High (pH 8-9.5) 3.41 8.18 -38.2 0 9 -1 140 361.359 4

Activity (Go SEA)

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