UCSF

ZINC34476915

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 13 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 0.14 -7.27 4 5 0 91 201.251 4
Mid Mid (pH 6-8) -1.56 0.48 -38.57 5 5 1 93 202.259 4

Activity (Go SEA)

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