UCSF

ZINC36881048

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 20 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) 0.00 6.18 -47.58 3 4 1 65 275.372 4
Hi High (pH 8-9.5) 0.00 5.91 -10.05 2 4 0 63 274.364 4

Activity (Go SEA)

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