UCSF

ZINC21004725

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2008 20 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) 3.26 9.23 -47.97 0 4 -1 62 288.348 6
Lo Low (pH 4.5-6) 3.26 9.35 -70.04 1 4 0 63 289.356 6
Lo Low (pH 4.5-6) 3.26 9.62 -67.73 1 4 0 63 289.356 6

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

No pre-computed analogs available. Try a structural similarity search.