| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]propan-1-one (2S)-2-amino-2-cyclopropyl-1-[4-…
| 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) | 1.84 | 7.13 | -93.79 | 4 | 4 | 2 | 52 | 309.479 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 5.89 | -9.03 | 2 | 4 | 0 | 50 | 307.463 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 5.23 | -40.04 | 3 | 4 | 1 | 51 | 308.471 | 4 | ↓ |
