UCSF

ZINC36106741

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 27 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) 1.57 1.18 -54.75 1 8 -1 111 396.489 7
Lo Low (pH 4.5-6) 1.94 2.72 -13.44 2 8 0 105 397.497 6

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

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