UCSF

ZINC00795086

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2004 25 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) 1.91 -1.99 -15.06 1 6 0 79 359.403 5
Mid Mid (pH 6-8) 1.32 -2.17 -21.29 0 6 0 76 359.403 5

Activity (Go SEA)

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