UCSF

ZINC59367709

Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2011 23 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) 0.80 -1.58 -11.27 3 8 0 120 315.285 3
Hi High (pH 8-9.5) 0.43 -4.11 -47.12 2 8 -1 126 314.277 3

Activity (Go SEA)

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