UCSF

ZINC31516327

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 30 No

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Annotations

Vendors

    None

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) -3.65 -1.28 -373.13 2 16 -4 255 492.163 9
Mid Mid (pH 6-8) -3.65 -2.44 -237.33 3 16 -3 253 493.171 9

Activity (Go SEA)

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