UCSF

ZINC69175874

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2011 30 Yes

Popular Name: 4-chloro-N-[(1S,2S)-2-methyl-1-[[4-(1-piperidylmethyl)thiazol-2-yl]carbamoyl]butyl]benzamide 4-chloro-N-[(1S,2S)-2-methyl-1-[…

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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) 4.23 10.59 -38.42 3 6 1 76 450.028 8 ↓
Hi High (pH 8-9.5) 4.23 8.36 -8.37 2 6 0 74 449.02 8 ↓

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

No pre-computed analogs available. Try a structural similarity search.