| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-(cyclopropylmethyl)-N,1-diisopropyl-pyrrolidin-3-amine (3S)-3-(aminomethyl)-N-(cyclopro…
| 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) | 1.58 | 5.17 | -25.4 | 3 | 3 | 1 | 34 | 254.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 5.39 | -30.6 | 3 | 3 | 1 | 34 | 254.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 3.9 | -41.7 | 3 | 3 | 1 | 34 | 254.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 2.84 | -0.99 | 2 | 3 | 0 | 32 | 253.434 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 7.08 | -94.87 | 4 | 3 | 2 | 35 | 255.45 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 5.52 | -114.82 | 4 | 3 | 2 | 35 | 255.45 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.58 | 5.48 | -105.37 | 4 | 3 | 2 | 35 | 255.45 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.58 | 6.91 | -219.97 | 5 | 3 | 3 | 37 | 256.458 | 6 | ↓ |
