UCSF

ZINC38787163

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 29 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) 3.13 7.81 -23.93 1 6 0 75 428.583 6
Mid Mid (pH 6-8) 3.13 10.09 -47.16 2 6 1 76 429.591 6

Activity (Go SEA)

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