In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: 5-[(cycloheptylamino)methyl]-N,N-diethyl-thiazol-2-amine 5-[(cycloheptylamino)methyl]-N,N…
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) | 4.05 | 9 | -39.24 | 2 | 3 | 1 | 33 | 282.477 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.05 | 7.75 | -4.62 | 1 | 3 | 0 | 28 | 281.469 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.