UCSF

ZINC04557081

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2005 20 No

CAS Numbers: 345909-25-3 , 85-31-4

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) -1.67 -2.3 -27.47 6 9 0 142 299.312 2

Activity (Go SEA)

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