UCSF

ZINC03160614

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 16 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) 0.92 -2.29 -8.21 3 5 0 90 237.236 1
Hi High (pH 8-9.5) 0.92 -1.52 -38.11 2 5 -1 93 236.228 1

Activity (Go SEA)

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