UCSF

ZINC35284993

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2009 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) 1.93 4.52 -43.28 4 4 1 63 305.171 5
Hi High (pH 8-9.5) 1.93 2.19 -6.26 3 4 0 62 304.163 5

Activity (Go SEA)

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