In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 32 | Yes |
Popular Name: N-[[4-(m-tolyl)-5-(thiazol-2-ylcarbamoylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide N-[[4-(m-tolyl)-5-(thiazol-2-ylc…
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) | 2.84 | 10.67 | -19.83 | 2 | 8 | 0 | 102 | 464.576 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 9.44 | -48.72 | 1 | 8 | -1 | 108 | 463.568 | 8 | ↓ |