In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 25 | No |
Popular Name: 9-(2-amino-1,3-benzothiazole-5-carbonyl)-5-methyl-2,5,9-triazaspiro[5.5]undecan-1-one 9-(2-amino-1,3-benzothiazole-5-c…
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) | 0.38 | 3.41 | -53.86 | 4 | 7 | 1 | 93 | 360.463 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 1.23 | -15.85 | 3 | 7 | 0 | 92 | 359.455 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.