| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (1-aminocyclopentyl)-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone (1-aminocyclopentyl)-[4-(2-thien…
| 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) | 2.00 | 7.19 | -107.37 | 4 | 4 | 2 | 52 | 309.479 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 5.12 | -8.53 | 2 | 4 | 0 | 50 | 307.463 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 5.28 | -51.24 | 3 | 4 | 1 | 51 | 308.471 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 7 | -43.37 | 3 | 4 | 1 | 51 | 308.471 | 3 | ↓ |
