UCSF

ZINC25558033

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2009 31 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) 6.82 13.99 -11.08 0 6 0 80 429.501 4
Lo Low (pH 4.5-6) 6.82 14.51 -35.11 1 6 1 82 430.509 4

Activity (Go SEA)

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