UCSF

ZINC39376856

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2010 19 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) 3.96 7.63 -30.08 1 2 1 26 253.3 2
Lo Low (pH 4.5-6) 3.96 8.04 -101.07 2 2 2 28 254.308 2

Activity (Go SEA)

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