UCSF

ZINC07612960

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 17 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) -3.35 -4.27 -35.24 1 5 1 41 242.343 6
Mid Mid (pH 6-8) -3.35 -0.93 -105.45 2 5 2 42 243.351 6

Activity (Go SEA)

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