UCSF

ZINC03649768

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 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) -2.02 -0.67 -54.33 6 7 0 140 282.296 8
Hi High (pH 8-9.5) -2.02 -1.8 -61.27 5 7 -1 136 281.288 8

Activity (Go SEA)

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