In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 17 | No |
Popular Name: (7S)-2-[methyl-[(3R)-tetrahydrothiophen-3-yl]amino]-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol (7S)-2-[methyl-[(3R)-tetrahydrot…
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) | 1.99 | 5.1 | -6.61 | 1 | 3 | 0 | 36 | 270.423 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | 5.41 | -28.06 | 2 | 3 | 1 | 38 | 271.431 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.