UCSF

ZINC38583248

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 18 No

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Annotations

None

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) 1.53 1.89 -52.89 0 4 -1 52 280.398 1
Mid Mid (pH 6-8) 1.07 3.75 -13.26 1 4 0 49 281.406 1
Mid Mid (pH 6-8) 1.53 4.19 -84.17 1 4 0 53 281.406 1
Lo Low (pH 4.5-6) 1.07 6.05 -65.2 2 4 1 50 282.414 1

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