UCSF

ZINC14436379

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2008 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 0.24 -5.41 -14.18 6 8 0 148 320.253 1
Hi High (pH 8-9.5) 0.24 -4.68 -54.17 5 8 -1 151 319.245 1
Hi High (pH 8-9.5) 0.24 -5.12 -55.23 5 8 -1 151 319.245 1
Hi High (pH 8-9.5) 0.24 -4.35 -54.11 5 8 -1 151 319.245 1
Hi High (pH 8-9.5) 0.24 -4.7 -59.98 5 8 -1 151 319.245 1

Activity (Go SEA)

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