UCSF

ZINC32505603

Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2009 26 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) 3.28 5.32 -22.99 0 5 0 67 402.488 4
Lo Low (pH 4.5-6) 3.28 6.87 -45.42 1 5 1 68 403.496 4

Activity (Go SEA)

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