| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-1-[cyclopropyl(3-thienylmethyl)amino]-3-(methylamino)propan-2-ol (2S)-1-[cyclopropyl(3-thienylmet…
| 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) | 0.84 | 2.33 | -39.15 | 3 | 3 | 1 | 40 | 241.38 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.84 | 0.9 | -3.71 | 2 | 3 | 0 | 35 | 240.372 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.84 | 2.83 | -33.86 | 3 | 3 | 1 | 37 | 241.38 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 4.8 | -40.72 | 3 | 3 | 1 | 44 | 241.38 | 7 | ↓ |
