UCSF

ZINC34477474

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 12 Yes

CAS Number: 138540-99-5

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) -1.26 -1.88 -9.82 2 4 0 67 172.18 0

Activity (Go SEA)

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