UCSF

ZINC33815733

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 22 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) -1.87 -1.35 -59.49 6 12 -1 195 333.221 7
Lo Low (pH 4.5-6) -1.87 -0.85 -71.95 7 12 0 196 334.229 7

Activity (Go SEA)

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