UCSF

ZINC12358942

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 29 No

CAS Number: 6160-80-1

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) 1.33 -1.98 -50.63 3 9 -1 149 407.395 3

Activity (Go SEA)

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