UCSF

ZINC36911651

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2009 19 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) 4.70 9.87 -8.14 0 2 0 18 282.79 4
Lo Low (pH 4.5-6) 4.70 10.03 -26.81 1 2 1 19 283.798 4

Activity (Go SEA)

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