UCSF

ZINC16927843

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 26 No

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 3.46 6.8 -64.33 1 7 -1 108 368.394 4
Lo Low (pH 4.5-6) 3.46 6.69 -79.11 2 7 0 109 369.402 4

Activity (Go SEA)

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