UCSF

ZINC39917230

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 31 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) 4.11 10.66 -45.18 1 6 1 44 423.581 9
Mid Mid (pH 6-8) 4.11 11.53 -90.04 2 6 2 45 424.589 9
Mid Mid (pH 6-8) 4.11 10.57 -40.94 1 6 1 44 423.581 9
Mid Mid (pH 6-8) 4.11 8.31 -12.21 0 6 0 43 422.573 9

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