UCSF

ZINC38715862

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 23 Yes

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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) 1.28 3.35 -54.4 1 6 -1 90 330.389 6
Mid Mid (pH 6-8) 1.28 3.21 -15.15 2 6 0 88 331.397 6
Lo Low (pH 4.5-6) 1.28 3.81 -55.79 2 6 0 91 331.397 6

Activity (Go SEA)

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