UCSF

ZINC27638809

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2009 30 Yes

CAS Number: 37497-47-5

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) 1.90 3.2 -18.45 4 7 0 124 426.55 16

Activity (Go SEA)

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