UCSF

ZINC19881630

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 17 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) 0.10 2.04 -8.23 0 5 0 50 240.303 3
Ref Reference (pH 7) 0.10 2.3 -7.61 0 5 0 50 240.303 3
Lo Low (pH 4.5-6) 0.10 4.55 -44.71 1 5 1 51 241.311 3

Activity (Go SEA)

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