| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2009 | 17 | Yes |
Popular Name: (1S)-N-cyclopentyl-N-ethyl-1-(3-methyl-2-thienyl)ethane-1,2-diamine (1S)-N-cyclopentyl-N-ethyl-1-(3-…
| 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) | 2.78 | 4.71 | -43.07 | 3 | 2 | 1 | 31 | 253.435 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 3.95 | -1.5 | 2 | 2 | 0 | 29 | 252.427 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.78 | 6.68 | -117.1 | 4 | 2 | 2 | 32 | 254.443 | 5 | ↓ |
