UCSF

ZINC17176697

Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 12 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) -1.62 -4.38 -43.56 5 6 1 103 192.22 3
Hi High (pH 8-9.5) -1.62 -5.6 -25.81 4 6 0 101 191.212 3

Activity (Go SEA)

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