| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 21 | Yes |
Popular Name: (7S)-2-(4-methyl-1,4-diazepan-1-yl)-N-propyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine (7S)-2-(4-methyl-1,4-diazepan-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) | 2.94 | 9.56 | -82.93 | 3 | 4 | 2 | 37 | 310.511 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 6.26 | -6.46 | 1 | 4 | 0 | 31 | 308.495 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 7.6 | -37.7 | 2 | 4 | 1 | 36 | 309.503 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.94 | 9.98 | -168 | 4 | 4 | 3 | 38 | 311.519 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
