In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | Yes |
Popular Name: (7S)-2-[cyclopentyl(ethyl)amino]-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol (7S)-2-[cyclopentyl(ethyl)amino]…
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) | 3.12 | 6.47 | -5.85 | 1 | 3 | 0 | 36 | 266.41 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 6.47 | -23.35 | 2 | 3 | 1 | 38 | 267.418 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.