UCSF

ZINC08917983

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 38 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) 1.56 -4.83 -21.42 4 9 0 141 525.646 7
Lo Low (pH 4.5-6) 1.56 -4.72 -52.95 5 9 1 142 526.654 7

Activity (Go SEA)

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