In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 24 | No |
Popular Name: 2-guanidino-N-(4-isopropyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide 2-guanidino-N-(4-isopropyl-1,3-b…
None
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) | 3.47 | 7.14 | -12.33 | 5 | 7 | 0 | 119 | 360.468 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 6.16 | -63.79 | 4 | 7 | -1 | 123 | 359.46 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 5.96 | -41.01 | 6 | 7 | 1 | 122 | 361.476 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.