UCSF

ZINC02516152

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 18 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) -0.24 -3.19 -7.95 5 6 0 105 255.27 2
Lo Low (pH 4.5-6) -0.24 -3.32 -49.22 6 6 1 107 256.278 2

Activity (Go SEA)

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