| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 20 | Yes |
Popular Name: (2S)-3-(1,3-benzothiazol-2-ylsulfanyl)-2-cyclopropyl-2-(methylamino)propanamide (2S)-3-(1,3-benzothiazol-2-ylsul…
| 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) | 2.54 | 3.8 | -46.19 | 4 | 4 | 1 | 73 | 308.452 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 2.67 | -10.5 | 3 | 4 | 0 | 68 | 307.444 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
