In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 18 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-(cyclopropylmethyl)-N-isopropyl-quinuclidin-3-amine (3R)-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) | 1.41 | 3.51 | -116.15 | 4 | 3 | 2 | 35 | 253.434 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 2.39 | -0.83 | 2 | 3 | 0 | 32 | 251.418 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 2.5 | -43.16 | 3 | 3 | 1 | 34 | 252.426 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 4.65 | -30.41 | 3 | 3 | 1 | 34 | 252.426 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 5.66 | -95.19 | 4 | 3 | 2 | 35 | 253.434 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 4.93 | -109.92 | 4 | 3 | 2 | 35 | 253.434 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 5.96 | -211.24 | 5 | 3 | 3 | 37 | 254.442 | 5 | ↓ |