UCSF

ZINC03938715

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2005 27 No

CAS Number: 61545-06-0

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) -1.96 -6 -107.61 1 9 -2 138 412.445 6

Activity (Go SEA)

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