UCSF

ZINC39881436

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 34 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) 6.04 14.63 -36.62 2 5 1 59 445.546 3
Mid Mid (pH 6-8) 6.04 14.51 -16.82 1 5 0 58 444.538 3
Lo Low (pH 4.5-6) 6.04 15.01 -64.47 3 5 2 61 446.554 3

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