UCSF

ZINC36621488

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 23 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) 4.03 9.35 -30.42 1 3 1 26 327.404 1
Hi High (pH 8-9.5) 4.03 7.98 -11.74 0 3 0 25 326.396 1

Activity (Go SEA)

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