UCSF

ZINC70647132

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2011 25 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) -1.18 -1.3 -12.85 3 8 0 126 354.355 3
Hi High (pH 8-9.5) -1.18 -0.6 -63.4 2 8 -1 129 353.347 3

Activity (Go SEA)

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