UCSF

ZINC02655924

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2004 27 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) 1.66 0.53 -47.51 2 9 -1 141 373.389 8
Mid Mid (pH 6-8) 1.48 2.99 -16.53 3 9 0 134 374.397 8

Activity (Go SEA)

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