UCSF

ZINC03872622

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 29 Yes

CAS Number: 66575-29-9

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) 1.71 4.6 -8.35 3 7 0 113 410.507 3

Activity (Go SEA)

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