UCSF

ZINC00183900

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 20 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) 0.59 -1.86 -15.82 2 5 0 77 275.304 4
Mid Mid (pH 6-8) 0.01 -2.09 -27.21 1 5 0 74 275.304 4

Activity (Go SEA)

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