UCSF

ZINC21806246

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2008 21 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) 2.54 2.86 -15.08 2 7 0 112 308.315 4
Mid Mid (pH 6-8) 2.54 2.93 -42.11 1 7 -1 114 307.307 4

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