In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 21 | Yes |
Popular Name: 3-[(2S)-2-aminopropyl]-N-(cyclopropylmethyl)-N-ethyl-quinolin-2-amine 3-[(2S)-2-aminopropyl]-N-(cyclop…
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) | 2.95 | 9.2 | -50.85 | 3 | 3 | 1 | 44 | 284.427 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.95 | 9.65 | -96.61 | 4 | 3 | 2 | 45 | 285.435 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.