In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 19 | Yes |
Popular Name: (7S)-N,5,5-trimethyl-2-(2-thienylmethyl)-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7S)-N,5,5-trimethyl-2-(2-thieny…
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) | 4.15 | 7.72 | -42.85 | 2 | 2 | 1 | 29 | 293.481 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 6.31 | -5.17 | 1 | 2 | 0 | 25 | 292.473 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.