In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 22 | No |
Popular Name: (6S)-6-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine (6S)-6-(4-phenyl-3,6-dihydro-2H-…
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) | 3.45 | 9.66 | -44.55 | 3 | 3 | 1 | 43 | 312.462 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 7.44 | -6.43 | 2 | 3 | 0 | 42 | 311.454 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.45 | 10.09 | -92.95 | 4 | 3 | 2 | 45 | 313.47 | 2 | ↓ |