UCSF

ZINC44174525

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 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) 3.42 7.4 -16.9 2 6 0 80 417.437 8
Hi High (pH 8-9.5) 3.48 5.98 -50.85 1 6 -1 87 416.429 8

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