| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: (3S)-3-amino-4-(4-cyclopropylpiperazin-1-yl)-4-oxo-butanamide (3S)-3-amino-4-(4-cyclopropylpip…
| 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) | -0.99 | -2.55 | -39.08 | 5 | 6 | 1 | 94 | 241.315 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.99 | -2.88 | -10.55 | 4 | 6 | 0 | 93 | 240.307 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.99 | -0.19 | -95.28 | 6 | 6 | 2 | 95 | 242.323 | 4 | ↓ |
