In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 18 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[3-[(3S)-3-piperidyl]propyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[3-[(3S)-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) | 1.36 | 6.37 | -78.81 | 4 | 3 | 2 | 33 | 253.434 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.36 | 4.03 | -37.72 | 3 | 3 | 1 | 32 | 252.426 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 7.54 | -179.52 | 5 | 3 | 3 | 38 | 254.442 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 5.2 | -98.18 | 4 | 3 | 2 | 36 | 253.434 | 6 | ↓ |