UCSF

ZINC09086308

Substance Information

In ZINC since Heavy atoms Benign functionality
August 7th, 2007 32 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) 4.01 10.53 -54.71 2 6 1 71 520.831 7
Mid Mid (pH 6-8) 3.43 11.2 -66.72 1 6 1 68 520.831 7

Activity (Go SEA)

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