UCSF

ZINC11865214

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2008 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) 2.13 -0.31 -10.86 1 4 0 63 253.257 1
Lo Low (pH 4.5-6) 2.13 -0.21 -43.37 2 4 1 65 254.265 1

Activity (Go SEA)

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