UCSF

ZINC36221925

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 25 No

Other Names:

DNC013079

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) -0.72 2.14 -85.99 2 7 0 100 367.423 2
Hi High (pH 8-9.5) -0.72 -0.1 -49.99 1 7 -1 99 366.415 2

Activity (Go SEA)

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