| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-1-isopropyl-N-[3-(4-methylpiperazin-1-yl)propyl]pyrrolidin-3-amine (3S)-1-isopropyl-N-[3-(4-methylp…
| 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) | 1.11 | 4.14 | -86.72 | 3 | 4 | 2 | 28 | 270.465 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 6.46 | -193.34 | 4 | 4 | 3 | 29 | 271.473 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 4.19 | -110.26 | 3 | 4 | 2 | 28 | 270.465 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 4.04 | -106.2 | 3 | 4 | 2 | 28 | 270.465 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 1.77 | -39.57 | 2 | 4 | 1 | 26 | 269.457 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.11 | 6.56 | -167.54 | 4 | 4 | 3 | 29 | 271.473 | 6 | ↓ |
