UCSF

ZINC48871968

Substance Information

In ZINC since Heavy atoms Benign functionality
September 20th, 2010 19 No

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Annotations

Vendors

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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) -0.65 1.18 -48.94 4 6 1 88 266.321 6
Hi High (pH 8-9.5) -0.65 -1.04 -19.93 3 6 0 87 265.313 6

Activity (Go SEA)

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