UCSF

ZINC31792936

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2009 23 No

CAS Number: 144110-37-2

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) -0.69 6.9 -105.63 8 7 1 151 321.401 10
Mid Mid (pH 6-8) -0.69 6.6 -65.84 7 7 0 149 320.393 10

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