UCSF

ZINC32193772

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 36 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) 4.07 8.69 -101.49 0 9 -2 134 504.882 7
Lo Low (pH 4.5-6) 3.62 10.46 -62.32 1 9 -1 131 505.89 7

Activity (Go SEA)

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