UCSF

ZINC61655926

Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2011 21 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) 1.93 7.53 -38.23 1 7 1 70 359.248 5
Hi High (pH 8-9.5) 1.93 5.04 -4.45 0 7 0 68 358.24 5

Activity (Go SEA)

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