UCSF

ZINC36162664

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 17 Yes

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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) 4.16 10.55 -47.13 0 2 -1 40 231.315 6
Lo Low (pH 4.5-6) 4.16 8.51 -4.25 1 2 0 37 232.323 6

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Rings

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