In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2011 | 20 | Yes |
Popular Name: (3S)-N-isopropyl-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)heptan-3-amine (3S)-N-isopropyl-3-(4,5,6,7-tetr…
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) | 5.15 | 8.9 | -30.84 | 2 | 2 | 1 | 29 | 295.516 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.15 | 8.53 | -2.94 | 1 | 2 | 0 | 25 | 294.508 | 7 | ↓ |