UCSF

ZINC32606787

Substance Information

In ZINC since Heavy atoms Benign functionality
May 6th, 2009 29 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) 3.28 7.39 -55.48 2 6 0 84 395.365 3
Hi High (pH 8-9.5) 3.74 6.97 -52.73 1 6 -1 87 394.357 3
Lo Low (pH 4.5-6) 3.28 7.84 -66.19 3 6 1 85 396.373 3

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