UCSF

ZINC13828854

Substance Information

In ZINC since Heavy atoms Benign functionality
June 26th, 2008 21 Yes

CAS Numbers: 136159-62-1 , N/A

Other Names:

MFCD23723102

N/A

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) 3.01 9.89 -10.15 0 5 0 56 293.363 8

Activity (Go SEA)

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