In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 18 | Yes |
Popular Name: 4-amino-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrrole-2-carboxamide 4-amino-N-(4,5,6,7-tetrahydro-1,…
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) | 1.69 | 3.34 | -15.9 | 4 | 5 | 0 | 84 | 262.338 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 1.54 | -30.74 | 4 | 5 | 1 | 85 | 263.346 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.