UCSF

ZINC02438400

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2004 32 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) 3.83 4.77 -11.54 3 8 0 108 502.365 6
Hi High (pH 8-9.5) 3.60 4.76 -59.66 1 8 -1 107 501.357 6
Hi High (pH 8-9.5) 3.83 5.77 -42.91 2 8 -1 111 501.357 6

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