UCSF

ZINC48954075

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 16 Yes

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Annotations

Vendors

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) 1.55 5.12 -9.56 1 4 0 45 219.288 1
Mid Mid (pH 6-8) 1.55 5.58 -35.71 2 4 1 46 220.296 1

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